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Scandium Nitrate, Scandium Trinitrate, Scandium Nitrate Hydrate, 13465‑60‑6

Scandium Nitrate, Scandium Trinitrate, Scandium Nitrate Hydrate, 13465‑60‑6

SCANDIUM(III) NITRATE (HYDRATE) 

Chemical Name: Scandium(III) Nitrate / Scandium Trinitrate
CAS Number: 13465-60-6
EC Number: 236-809-4
HS Code: 283429

1. PRODUCT IDENTIFICATION AND CHEMICAL IDENTITY

Parameter Description
Turkish Name Skandiyum(III) Nitrat
English Name Scandium(III) nitrate
Other Names (Synonyms) Scandium trinitrate, Scandium nitrate hydrate
CAS Number 13465-60-6
EC Number (EINECS) 236-809-4
HS Code 283429
Molecular Formula Sc(NO₃)₃·xH₂O (typically hydrated form)
Molecular Weight Approximately 230 g/mol for anhydrous Sc(NO₃)₃ (varies with hydration state)
Chemical Class Inorganic salt (rare earth-like metal nitrate, hydrate)
Appearance White crystalline solid
Odor Odorless
Hygroscopic Property Hygroscopic (moisture-absorbing)

2. CHEMICAL STRUCTURE AND EXPLANATION

Chemical Structure and Bonding:

Scandium(III) Nitrate is an ionic compound composed of one Scandium (Sc³⁺) cation and three Nitrate (NO₃⁻) anions. Scandium is in the +3 oxidation state (trivalent) in this compound. The molecule contains a variable number of water molecules of crystallization (typically 4-6 molecules, depending on the specific hydrate form). As a rare earth-like metal, scandium exhibits similar chemical behavior to other trivalent rare earth elements.

Molecular Formula Representation:

Sc(NO₃)₃·xH₂O (typically Sc(NO₃)₃·4H₂O or Sc(NO₃)₃·6H₂O)

This formula indicates the following structure:

  • 1 Scandium ion (Sc³⁺): Central metal atom.

  • 3 Nitrate groups (NO₃⁻): Trigonal planar anions.

  • x Water molecules (H₂O): Water of crystallization bound to the crystal lattice (variable).

Crystal Structure and Ionic Arrangement:

In the crystal structure, the Sc³⁺ ion is coordinated by oxygen atoms from nitrate groups and water molecules. Due to scandium's relatively small ionic radius (compared to lanthanides), it typically exhibits lower coordination numbers (6-8). Nitrate ions act as bridges between scandium centers. The water molecules are part of the crystal structure and impart specific thermal stability and solubility characteristics to the compound. Upon heating, these water molecules are sequentially removed (dehydration), eventually forming the anhydrous form.

Simplified Ionic Representation:

        Sc³⁺   NO₃⁻   H₂O
          \     /       /
           Sc(NO₃)₃ · xH₂O
          /     \       \
        NO₃⁻   NO₃⁻   H₂O

(An ionic crystal lattice composed of 1 Sc³⁺ ion, 3 NO₃⁻ ions, and x water molecules)

Structural Properties:

Property Description
Bond Type Ionic bonds and coordination bonds
Central Atom Scandium (Sc³⁺)
Coordination Number Typically 6-8
Anion Nitrate (NO₃⁻)
Water of Crystallization Variable (typically 4-6 molecules)
Oxidation State (Sc) +3 (trivalent)

Dehydration (Loss of Water upon Heating):

Scandium Nitrate Hydrate loses water sequentially when heated:

Sc(NO₃)₃·xH₂O → Sc(NO₃)₃·yH₂O → Sc(NO₃)₃ (anhydrous)

At higher temperatures, the nitrate groups decompose to form scandium oxide (Sc₂O₃) and nitrogen oxides (NOx).

3. PHYSICAL AND CHEMICAL PROPERTIES

Property Value / Description
Molecular Formula Sc(NO₃)₃·xH₂O (variable hydrate)
Molecular Weight Approximately 230 g/mol (anhydrous); varies with hydration
Appearance White crystalline solid
Odor Odorless
Density Approximately 2.5-2.7 g/cm³
Melting Point Decomposes at approximately 60°C (dissolves in its own water of crystallization)
pH (Aqueous Solution) Acidic (due to hydrolysis)
Solubility (Water) High solubility in water
Solubility (Ethanol) Soluble in ethanol
Solubility (Organic Solvents) Soluble in polar organic solvents
Hygroscopic Property Hygroscopic (moisture-absorbing)
Stability Stable under normal conditions; protect from moisture and light
Thermal Decomposition Products Scandium oxide (Sc₂O₃), nitrogen oxides (NO, NO₂), water vapor
Oxidizing Property Exhibits oxidizing properties (due to nitrate ions)

Important Physical Notes:

  • Scandium Nitrate is highly hygroscopic and rapidly absorbs moisture from the air, requiring special packaging and storage conditions.

  • It has a low melting point (~60°C); when heated, it dissolves in its own water of crystallization, forming a clear liquid.

  • It has high solubility in water and ethanol, making it suitable for various applications.

  • It exhibits oxidizing properties due to nitrate ions. Contact with organic materials should be avoided.

  • The exact hydration state (xH₂O) can vary depending on the preparation method and storage conditions.

  • High purity grades (≥ 99.9%) are available.

4. CHEMICAL PROPERTIES AND REACTIONS

Property Description
Chemical Class Inorganic salt (rare earth-like metal nitrate, hydrate)
Oxidation State (Scandium) +3 (trivalent)
Reactivity Exhibits oxidizing properties; reacts with organic substances and reducing agents.
Stability Protect from moisture and light. Decomposes upon heating.
Oxidizing Property Exhibits oxidizing properties due to nitrate ions.
Acid-Base Properties Forms acidic solutions in water due to hydrolysis.
Complex Formation Can form complexes with various ligands (e.g., EDTA, oxalate, citrate).
Hydrolysis Sc³⁺ ions hydrolyze in aqueous solutions: Sc³⁺ + H₂O ⇌ Sc(OH)²⁺ + H⁺

Important Reactions:

1. Thermal Decomposition:

This reaction is the primary method used for producing scandium oxide.

First, dehydration:
Sc(NO₃)₃·xH₂O → Sc(NO₃)₃ + xH₂O (approximately 60-200°C)

Then, thermal decomposition:
4 Sc(NO₃)₃ → 2 Sc₂O₃ + 12 NO₂ + 3 O₂ (high temperature, >600°C)

2. Reaction with Bases (Precipitation):

Scandium hydroxide precipitates, which can be used as an intermediate in scandium oxide production.

Sc(NO₃)₃ + 3 NaOH → Sc(OH)₃ ↓ + 3 NaNO₃

3. Dissolution and Hydrolysis in Water:

Hydrolysis of scandium ions causes the solution to become acidic.

Sc³⁺ + H₂O ⇌ Sc(OH)²⁺ + H⁺

4. Precipitation with Ammonia:

Sc(NO₃)₃ + 3 NH₃ + 3 H₂O → Sc(OH)₃ ↓ + 3 NH₄NO₃

5. Precipitation with Oxalate:

2 Sc(NO₃)₃ + 3 (NH₄)₂C₂O₄ → Sc₂(C₂O₄)₃ ↓ + 6 NH₄NO₃

5. APPLICATIONS AND INDUSTRIAL USES

5.1. Aerospace and High-Performance Alloys (Most Important Application)

Scandium Nitrate is a precursor for the production of Aluminum-Scandium (Al-Sc) alloys, which are critical in the aerospace and defense industries. Al-Sc alloys offer low density, high strength, excellent corrosion resistance, and superior weldability. Scandium Nitrate is particularly valuable as a water-soluble scandium source for solution-based synthesis methods.

Application Description
Al-Sc Alloys Production of high-performance aluminum alloys for aerospace and defense.
Sports Equipment Bicycles, baseball bats, and other high-performance sporting equipment.
Automotive Lightweight, high-strength automotive components.
Military Applications Lightweight and durable materials for defense applications.

5.2. Optical and Specialty Glass

Application Description
Specialty Glasses Production of glasses with high refractive index and special optical properties.
Optical Coatings Additive in the production of specialty optical coatings.
Laser Crystals Scandium-doped laser crystals (e.g., Cr:ScAP, Cr:LiSAF).

5.3. Advanced Ceramics and Materials

Application Description
Advanced Ceramics Additive in the production of high-temperature ceramics.
Solid Oxide Fuel Cells (SOFC) Additive in electrolyte materials.
Thermal Barrier Coatings Thermal barrier coatings for high-temperature applications.
Electronic Ceramics Production of capacitors and other electronic components.

5.4. Catalyst Applications

Application Description
Oxidation Catalysts Catalysts in various oxidation reactions.
Petrochemical Catalysts Catalysts in petroleum refining and chemical synthesis.
Perovskite Catalysts Precursor for the synthesis of perovskite-structured catalysts.

5.5. Laboratory and Research

Application Description
Scandium Chemistry Starting material for the synthesis of other scandium compounds.
Analytical Reagent Used in scandium determination and other analytical methods.
Materials Science Research reagent for the development of new materials.
Organic Synthesis Catalyst or reagent in organic transformations.

5.6. Electronics

Application Description
Semiconductors Production of advanced semiconductor materials.
Piezoelectric Materials Specialty piezoelectric applications.
Dielectric Materials Production of materials with high dielectric constant.

6. SECTORAL SUITABILITY TABLE

Sector / Application Suitability Description
Textile No application. No use in the textile industry.
Food Prohibited. Not permitted as a food additive or in food contact materials.
Cosmetics Prohibited. Prohibited in cosmetic formulations under CLP/REACH.
Metal / Surface Treatment Suitable. Used in Al-Sc alloys and coatings.
Ceramics / Glass Suitable. Used in specialty glass and advanced ceramic production.
Laboratory / Research Highly suitable. Widely used as a reagent in rare metal chemistry.
Electronics / Optics Highly suitable. Critical use in alloys, optical, and electronic materials.
Construction Chemicals No application. No use in the construction sector.

7. SAFETY AND TOXICOLOGY

Parameter Value / Description
GHS Classification Oxidizer, Harmful
H-Statements (Hazard Statements) H272: May intensify fire; oxidizer.
H302: Harmful if swallowed.
H315: Causes skin irritation.
H319: Causes serious eye irritation.
P-Statements (Precautionary Statements) P210: Keep away from heat/sparks/open flames.
P220: Keep/Store away from clothing/combustible materials.
P264: Wash hands thoroughly after handling.
P280: Wear protective gloves and eye/face protection.
P302+P352: IF ON SKIN: Wash with plenty of soap and water.
P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes (15 minutes).
Acute Toxicity (Oral) Harmful if swallowed.
Skin Irritation Irritant.
Eye Irritation Causes serious eye irritation.
Inhalation Dust inhalation may irritate the respiratory tract.
Carcinogenicity Not classified as a carcinogen.
Mutagenicity Not classified as a mutagen.
Reproductive Toxicity Not classified.
Environmental Impact Soluble salt; release into the environment should be prevented. Scandium compounds may exhibit toxic effects in aquatic environments.
Bioaccumulation Not likely.
WGK (Germany) 2 (water pollutant)

Safety Precautions:

  • Keep away from heat, sparks, and open flames.

  • Store separately from combustible materials.

  • Avoid dust formation.

  • Work in well-ventilated areas.

  • Use protective gloves, safety goggles, and dust mask.

  • Wash hands thoroughly after handling.

  • In case of eye contact, rinse with plenty of water for at least 15 minutes and seek medical attention.

  • Avoid contact with organic materials.

8. STORAGE AND HANDLING

Parameter Information
Storage Conditions Store in a cool, dry, well-ventilated area in the original tightly closed container.
Protection from Moisture Must be strictly protected from moisture due to hygroscopic properties.
Temperature Store in a cool environment (15-25°C). Avoid high temperatures.
Protection from Light Protect from direct sunlight.
Materials to Avoid Organic materials, reducing agents, combustible materials, moisture, acids.
Packaging Type Tightly closed plastic or glass containers that prevent moisture ingress (preferably HDPE or aluminum foil bags).
Shelf Life Approximately 2 years under proper storage conditions.
Handling Notes Avoid dust formation. Use closed systems and local exhaust ventilation. Wear protective gloves, goggles, and dust mask. Wash hands after handling. Do not contact with organic materials.

9. TRANSPORT AND REGULATORY INFORMATION

Parameter Information
UN Number UN 1479 (Oxidizing solid, n.o.s.) or UN 1477 (Nitrate, inorganic)
Hazard Class 5.1 (Oxidizing substances)
Packing Group II or III (depending on concentration)
Proper Shipping Name Oxidizing solid, n.o.s. (Scandium nitrate)
Marine Pollutant No.
ADR/RID Class 5.1, Oxidizer
IMDG Code Class 5.1, Oxidizer
IATA Class 5.1, Oxidizer
REACH Compliance (EU) Registration is mandatory under REACH.
KKDİK Compliance (Turkey) Registration and notification are mandatory.
TSCA (USA) Listed.
Food/Cosmetic Approval Not approved for food or cosmetic use.
Halal/Kosher Certification Not available.
ISO 9001 Production may be ISO 9001 compliant (depending on supplier).

10. QUALITY AND PURITY

Parameter Description
Purity Grades Rare earth-like metal purity: ≥ 99.9%
High purity: ≥ 99.99%
Analytical grade: ≥ 99.999%
Application Quality Metallurgical grade (for Al-Sc alloys), optical grade, catalyst grade, analytical grade.
Major Impurities Other metals (particularly iron, calcium, magnesium, aluminum), other transition metals, moisture content.
Analytical Methods ICP-MS, ICP-OES (elemental analysis), Karl Fischer (moisture determination), XRF (elemental analysis).
Particle Size Crystalline or fine powder.

11. RAW MATERIALS AND DOWNSTREAM PRODUCTS

11.1. Raw Materials (Upstream)

Raw Material Description
Scandium Oxide (Sc₂O₃) Obtained by extraction from scandium-containing minerals (e.g., thortveitite) or as a byproduct from rare earth and uranium processing.
Nitric Acid (HNO₃) Used for dissolving scandium oxide.
Water (H₂O) Used for crystallization and solution preparation.

11.2. Downstream Products

Downstream Product Application
Scandium Oxide (Sc₂O₃) Produced in high purity; optical, ceramic, and alloy applications.
Aluminum-Scandium Alloys Aerospace, defense, sports equipment, automotive.
Scandium Metal Production of high-purity scandium metal.
Scandium Salts (Chloride, Sulfate) Synthesis of other scandium compounds.
Optical Coatings Specialty optical coatings.
Perovskite Catalysts Scandium-containing perovskite catalysts.

12. FIRST AID MEASURES

Exposure Route Action to Take
Inhalation Move person to fresh air. If breathing is difficult, give oxygen. Seek medical attention.
Skin Contact Wash with plenty of soap and water. Remove contaminated clothing. If irritation persists, seek medical attention.
Eye Contact Rinse immediately with plenty of water for at least 15 minutes. Keep eyelids open. Remove contact lenses if present. Seek medical attention.
Ingestion Rinse mouth with water. Drink plenty of water. Do not induce vomiting. Seek medical attention.

13. FIREFIGHTING MEASURES

Parameter Information
Fire Hazard Oxidizing substance; may intensify fire. May cause fire upon contact with combustible materials.
Extinguishing Media Water spray, CO₂, dry chemical powder, alcohol foam.
Special Hazards Thermal decomposition produces toxic and irritating fumes (nitrogen oxides).
Protective Equipment Self-contained breathing apparatus (SCBA), full protective clothing.
Keep Away from Combustibles In case of fire, remove from other combustible materials.

14. ACCIDENTAL RELEASE MEASURES

Parameter Information
Personal Protection Wear appropriate PPE (dust mask, safety goggles, protective clothing, nitrile gloves).
Ventilation Increase ventilation.
Control Contain to prevent dust spread.
Cleaning Methods Use vacuum or carefully sweep to prevent dust generation; place in appropriate disposal container.
Environmental Precautions Prevent entry into drains, sewers, and water bodies.
Waste Disposal Dispose of according to local regulations.

15. SUMMARY AND CRITICAL WARNINGS

SUMMARY:

Scandium(III) Nitrate (Sc(NO₃)₃·xH₂O, CAS 13465-60-6) is an inorganic salt composed of one Scandium (Sc³⁺) and three Nitrate (NO₃⁻) ions, containing a variable number of water molecules of crystallization. It appears as a white crystalline solid, is highly soluble in water and ethanol, and is hygroscopic (moisture-absorbing). As a rare earth-like metal, scandium exhibits similar chemical behavior to other trivalent rare earth elements.

Its most critical application is as a precursor for Aluminum-Scandium (Al-Sc) alloys used in the aerospace and defense industries. It is also used in specialty glasses, optical coatings, advanced ceramics, as a catalyst, and as a laboratory reagent for scandium chemistry research.

Under GHS classification, it is an oxidizer and harmful (H272, H302, H315, H319). Due to nitrate ions, it exhibits oxidizing properties and must be kept away from organic/reducing substances. Due to its hygroscopic nature, it must be stored in a cool, dry environment in tightly closed packaging. Appropriate Personal Protective Equipment (PPE) must be used during handling to avoid inhalation of dust and contact with skin/eyes.

Key Properties:

Property Value
Appearance White crystalline solid
Chemical Formula Sc(NO₃)₃·xH₂O (variable hydrate)
Molecular Weight Approximately 230 g/mol (anhydrous); varies with hydration
CAS Number 13465-60-6
EC Number 236-809-4
Density Approximately 2.5-2.7 g/cm³
Melting Point Decomposes at approximately 60°C
Solubility in Water High solubility
Solubility in Ethanol Soluble
Hygroscopic Yes
Oxidizing Property Yes (due to nitrate ions)
GHS Classification Oxidizer, Harmful (H272, H302, H315, H319)
Primary Use Aerospace alloys (Al-Sc), optical materials, catalysts

CRITICAL WARNINGS:

1. Oxidizing Property: Exhibits oxidizing properties due to nitrate ions. Contact with organic materials, reducing agents, and combustible materials must be avoided. May intensify fire (H272). Therefore, it must be stored separately and away from combustible and reducing materials.

2. Hygroscopic Property and Moisture Sensitivity: Highly hygroscopic and rapidly absorbs moisture from the air. Storage and weighing operations must not be performed in humid environments. After opening, the container must be quickly resealed and storage under an inert atmosphere (nitrogen, argon) is preferred. Moisture absorption compromises weighing accuracy and stoichiometry.

3. Low Melting Point and Thermal Instability: Melts at approximately 60°C by dissolving in its own water of crystallization. This is an important property to consider during thermal processes. At higher temperatures, nitrate groups decompose, releasing toxic nitrogen oxides (NO, NO₂). Thermal processes should be conducted in well-ventilated areas or under fume hoods.

4. Variable Hydration State: The product may contain a variable number of water molecules of crystallization. Different hydrate forms have different molecular weights. The exact hydration state should be confirmed with the supplier. Stoichiometric calculations must account for the water content.

5. Structure and Purity: High purity (≥ 99.9%) is critical for metallurgical, optical, and electronic applications. Even trace amounts of other metals can adversely affect alloy properties or optical performance.

6. Dust Control: The powder form can irritate the lungs if inhaled. Dust control measures must be implemented in the work area (closed systems, local exhaust ventilation) and appropriate respiratory protection (dust mask or N95/FFP2) must be used.

7. Aqueous Solution Acidity: Aqueous solutions are acidic due to hydrolysis. Appropriate protective equipment should be used when working with acidic solutions, and base solutions should be available for neutralization.

8. Environmental Precautions: As a water-soluble salt, release into the environment (particularly water sources) must be prevented. Scandium compounds may exhibit toxic effects in aquatic environments. Waste solutions must not be discharged into sewers and must be disposed of according to local regulations.

9. Regulatory Compliance: Registration and notification requirements under REACH and KKDİK must be observed. It is classified as Class 5.1 (Oxidizing substance) under ADR/IMDG/IATA, requiring special labeling and documentation during transport. Use in food, cosmetics, and textile sectors is strictly prohibited.

10. Special Warning for Al-Sc Alloy Applications: For Al-Sc alloy production, the purity of scandium nitrate is critical. Impurities such as iron, silicon, and other transition metals can significantly degrade alloy properties. Additionally, the nitrate decomposition temperature and residual carbon/oxygen content after processing must be carefully controlled to avoid contamination of the final alloy.

11. Special Warning for Optical Applications: For optical applications, the nitrate content must be completely decomposed to avoid light absorption or scattering. Thermal treatment protocols should be optimized to ensure complete nitrate removal without introducing other defects.

12. Scandium Supply Chain Considerations: Scandium is a scarce and expensive metal. Efficient use, recovery, and recycling of scandium-containing materials should be considered. The nitrate form is particularly useful for solution-based processing and recovery methods.

Disclaimer: This Technical Data Sheet (TDS) is for informational purposes only. The information provided is based on available data and is believed to be accurate. However, the user is solely responsible for determining the suitability of the product for their specific applications and for complying with all applicable regulations and safety requirements. For complete safety, handling, storage, and regulatory compliance information, always refer to the official Safety Data Sheet (SDS/MSDS) provided by the manufacturer/supplier. Users are responsible for testing the product in their own processes and applications. All local, national, and international regulations must be followed when working with Scandium(III) Nitrate.

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