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Gadolinium Chloride Hexahydrate, 13450-84-5

Gadolinium Chloride Hexahydrate, 13450-84-5

GADOLINIUM CHLORIDE HEXAHYDRATE (GDCL₃·6H₂O)
GADOLINIUM CHLORIDE HEXAHYDRATE / GADOLINIUM(III) CHLORIDE HEXAHYDRATE
1. PRODUCT IDENTIFICATION AND CHEMICAL IDENTITY

Parameter Information
Product Name Gadolinium Chloride Hexahydrate
Chemical Name Gadolinium(III) Chloride Hexahydrate
Other Names Gadolinium Salt, GdCl₃·6H₂O
CAS Number 13450-84-5
EC Number (EINECS) 233-386-6 (anhydrous form)
Chemical Formula GdCl₃·6H₂O
Molecular Weight 371.70 g/mol
Appearance White crystalline powder
Odor Odorless
Physical State (20°C) Solid (crystalline powder)

2. CHEMICAL STRUCTURE
2.1. Molecular Structure
Gadolinium chloride hexahydrate is the hydrated form of the chloride salt of the rare earth element gadolinium. Gadolinium ions (Gd³⁺) and chloride ions (Cl⁻) are present in a 1:3 ratio. Each gadolinium chloride unit contains six molecules of water of hydration. It is readily soluble in water. Due to its hygroscopic nature, it is sensitive to degradation in humid environments.

Structural Features:

                    GADOLINIUM CHLORIDE HEXAHYDRATE [GdCl₃·6H₂O]
                          |
                Gd³⁺ - Cl⁻ Ionic Bonds + 6H₂O
                          |
        +----------------+----------------+
        |                |                |
    White Crystalline  Readily Soluble   Highly
    Powder             in Water          Hygroscopic

2.2. Structural Properties

Parameter Value
Crystal Structure Monoclinic
Chemical Formula GdCl₃·6H₂O
Molecular Weight 371.70 g/mol
Density ~2.42 g/mL (25 °C)
Appearance White crystalline powder
Melting Point ~609 °C (anhydrous form)
pH (1M solution) Slightly acidic (~5.0-6.0)

3. PHYSICAL AND CHEMICAL PROPERTIES

Property Value Description
Appearance White crystalline powder -
Odor Odorless -
Chemical Formula GdCl₃·6H₂O -
Molecular Weight 371.70 g/mol -
Density ~2.42 g/mL (25 °C) -
Melting Point ~609 °C Anhydrous form
Solubility in Water (25°C) Readily soluble -
Solubility in Alcohol Soluble -
Solubility in Acids Soluble -
pH (1M solution) Slightly acidic (~5.0-6.0) -
Stability Hygroscopic Must be stored in moisture-free conditions
Hygroscopicity High Rapidly absorbs moisture

4. PURITY GRADES

Parameter Technical Grade High Purity Grade Analytical Grade
Purity (GdCl₃·6H₂O) ≥ 99.0% ≥ 99.5% ≥ 99.9%
Gadolinium (Gd) Content ≥ 42.0% ≥ 42.5% ≥ 42.7%
Other Rare Earths ≤ 1.0% ≤ 0.5% ≤ 0.1%
Iron (Fe) ≤ 100 ppm ≤ 50 ppm ≤ 20 ppm
Calcium (Ca) ≤ 100 ppm ≤ 50 ppm ≤ 20 ppm
Sodium (Na) ≤ 100 ppm ≤ 50 ppm ≤ 20 ppm
Lead (Pb) ≤ 50 ppm ≤ 20 ppm ≤ 10 ppm
Sulfate (SO₄²⁻) ≤ 0.2% ≤ 0.1% ≤ 0.05%
Nitrate (NO₃⁻) ≤ 0.2% ≤ 0.1% ≤ 0.05%
Loss on Drying Variable Variable Variable
Particle Size (D50) 10-50 µm 5-20 µm 1-10 µm

5. STABILITY AND REACTIVITY

Parameter Information
Chemical Stability Hygroscopic; stable under dry, closed conditions.
Conditions to Avoid High humidity, exposure to open atmosphere, prolonged air contact, high temperatures.
Incompatible Materials Strong oxidizing agents, strong acids, alkali metals.
Hazardous Decomposition Products At high temperatures: hydrogen chloride (HCl) and gadolinium oxychloride (GdOCl).
Hazardous Polymerization Will not occur.
Hygroscopicity High; when exposed to air, it absorbs moisture and tends to deliquesce (become liquid).

5.1. Chemical Reactions

  • Thermal Decomposition (Hydrated Form):
    GdCl₃·6H₂O → GdCl₃ + 6H₂O (~100-200°C)
    GdCl₃ + H₂O → GdOCl + 2HCl (hydrolysis at high temperature)

  • Behavior in Aqueous Solution:
    GdCl₃(aq) → Gd³⁺(aq) + 3Cl⁻(aq)

  • Precipitation with Alkali:
    GdCl₃ + 3NaOH → Gd(OH)₃↓ + 3NaCl

6. APPLICATION AREAS
6.1. Medical and Imaging (MRI)

Application Function Details
MRI Contrast Agents Gadolinium source Critical raw material for Gd-based contrast agent production
Medical Imaging Paramagnetic contrast Magnetic Resonance Imaging (MRI) applications

6.2. Research and Rare Earth Chemistry

Application Function Details
Rare Earth Research Reagent and analysis Rare earth chemistry and physics research
Synthesis Precursor Starting material Synthesis of other gadolinium compounds
Standard Preparation Reference material Calibration and analysis studies

6.3. Phosphors and Lasers

Application Function Details
Phosphor Production Additive Special phosphor formulations
Laser Crystals Dopant Rare earth-doped laser systems

6.4. Catalyst Synthesis

Application Function Details
Organic Synthesis Catalyst Catalytic activity As Lewis acid in organic syntheses
Polymerization Catalyst Polymerization initiator Some polymerization reactions

6.5. Optics and Glass

Application Function Details
Special Glasses Optical additive Rare earth-doped optical glasses
Optical Materials Refractive index adjuster Special optical components

6.6. Sectoral Suitability Table

Sector Suitability Explanation
Pharmaceutical/Medical Suitable MRI contrast agents, imaging
Research Suitable Rare earth chemistry, synthesis, analysis
Electronics Suitable Phosphors, lasers, optical materials
Catalyst Suitable Organic synthesis, polymerization
Textile Not Suitable Not suitable
Food Not Suitable Not suitable
Cosmetics Not Suitable Not suitable

7. PRODUCTION PROCESS

Stage Process Description
1. Raw Material Preparation Gadolinium oxide (Gd₂O₃) High purity gadolinium oxide obtained
2. Acid Dissolution Dissolution in hydrochloric acid (HCl) Gd₂O₃ + 6HCl → 2GdCl₃ + 3H₂O
3. Filtration Removal of impurities Insoluble impurities are filtered out
4. Concentration Evaporation Solution is concentrated
5. Crystallization Hydrated form GdCl₃·6H₂O crystallized
6. Drying Controlled conditions Crystals dried under appropriate conditions
7. Packaging Moisture-proof packaging Packaged in moisture-proof containers due to hygroscopic nature

7.1. Major Producing Countries

Country Description
China Major producer
USA Rare earth production
Germany High purity production (Sigma-Aldrich, Alfa Aesar)
Japan High purity production

8. ALTERNATIVE / SUBSTITUTE PRODUCTS

Alternative Description When to Use
Gadolinium Nitrate Hexahydrate Gadolinium source When different anion is required
Gadolinium Oxide Gadolinium source When oxide form is required
Lanthanum Chloride Hexahydrate Similar chemical properties When La is required or lower cost
Cerium Chloride Hexahydrate Similar chemical properties When Ce is required
Gadolinium Acetate Organic synthesis When organic solvent compatibility is required

9. SAFETY AND TOXICOLOGY

Parameter Value
Acute Oral Toxicity (LD50, Rat) > 2,000 mg/kg (low toxicity)
Dermal Toxicity Low
Skin Irritation Mild to moderate irritant
Eye Irritation Serious irritant
Inhalation Dust inhalation may cause respiratory tract irritation.
Carcinogenicity Not classified as carcinogenic.
Mutagenicity Not mutagenic.
Chronic Effects Rare earth compounds have low bioavailability; however, high doses may cause liver effects.
Environmental Hazards Moderate aquatic toxicity; caution required due to chloride ion content.

9.1. GHS Classification

Hazard Class Category H-Statement
Acute Toxicity Category 4 H302: Harmful if swallowed.
Skin Irritation Category 2 H315: Causes skin irritation.
Eye Irritation Category 2A H319: Causes serious eye irritation.
Specific Target Organ Toxicity Category 3 H335: May cause respiratory irritation.

Signal Word: WARNING

Hazard Pictograms: GHS07 (Exclamation Mark)

10. PRECAUTIONARY STATEMENTS (P-CODES)

Code Statement
P261 Avoid breathing dust.
P264 Wash thoroughly after handling.
P270 Do not eat, drink or smoke when using this product.
P271 Use only in well-ventilated areas.
P280 Wear protective gloves/eye protection/face protection.
P301+P312 IF SWALLOWED: Call a POISON CENTER or doctor if you feel unwell.
P302+P352 IF ON SKIN: Wash with plenty of soap and water.
P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.
P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do.
P337+P313 If eye irritation persists: Get medical advice/attention.
P501 Dispose of contents/container in accordance with local regulations.

11. FIRST AID MEASURES

Exposure Route Action to Take
Inhalation Remove to fresh air. If symptoms persist, seek medical attention.
Skin Contact Wash with plenty of soap and water. Remove contaminated clothing. If irritation persists, seek medical attention.
Eye Contact Rinse thoroughly with plenty of water for at least 15 minutes. Remove contact lenses. If irritation persists, seek medical attention.
Ingestion Rinse mouth. Drink plenty of water. If large amount is swallowed, seek medical attention.

12. STORAGE AND SHELF LIFE

Parameter Condition
Storage Conditions Store in a cool, dry, and well-ventilated area. Ensure a moisture-free environment.
Container Requirements Moisture-proof, tightly closed containers. Vacuum-sealed or inert gas (N₂, Ar) packaging is recommended.
Temperature Room temperature (15-25°C).
Shelf Life 12-18 months under appropriate conditions (due to hygroscopic nature).
Stability Note Highly hygroscopic; rapidly degrades in humid environments. If left open, Gd(OH)₃ and Gd₂(CO₃)₃ may form.

13. PACKAGING OPTIONS

Packaging Type Quantity Material
Laboratory Packaging 25 g, 100 g HDPE bottle, PTFE-lined cap, inert atmosphere
Laboratory Packaging 500 g, 1 kg HDPE bottle, moisture-proof
Industrial Packaging 25 kg PE-lined bag, moisture-proof
Drum 25 kg, 50 kg HDPE drum, moisture-proof

14. TRANSPORT INFORMATION

Parameter Information
UN Number Not classified (specific regulations apply for rare earth compounds)
Hazard Class -
Packing Group -
ADR/RID Not regulated
IMDG Not regulated
IATA Not regulated
HS Code 2846.90.00.00.19 (Other rare earth compounds)

15. REGULATORY STATUS

Region / Authority Status
European Union (REACH) Registered
Turkey (KKDIK) Compliance required
TSCA (USA) Registered
FDA/EFSA Not suitable for food
ISO 9001:2015 Production compliance
TS EN 14001 Environmental management system compliance

16. OTHER NAMES AND SYNONYMS

Name Description
Gadolinium Salt Common name
Gadolinium(III) Chloride Hexahydrate Chemical name
GdCl₃·6H₂O Chemical abbreviation
Gadolinium Chloride Hexahydrate English name
Gadolinium Trichloride Hexahydrate Alternative chemical name

17. QUICK REFERENCE TABLE

Property Value
CAS Number 13450-84-5
EC Number 233-386-6
Chemical Formula GdCl₃·6H₂O
Molecular Weight 371.70 g/mol
Appearance White crystalline powder
Density ~2.42 g/mL
Solubility in Water Readily soluble
HS Code 2846.90.00.00.19
GHS Signal Word WARNING

18. CRITICAL WARNINGS AND BEST PRACTICES

CRITICAL WARNINGS:

  • Highly Hygroscopic Nature: Gadolinium chloride hexahydrate has a very high moisture absorption capacity. When exposed to air, it rapidly absorbs moisture, begins to dissolve, and loses its quality. Extreme care must be taken to avoid moisture during storage and handling.

  • Thermal Decomposition: Above ~200°C, water loss begins; at higher temperatures, toxic hydrogen chloride (HCl) gas is released. Ventilation is essential.

  • Incompatibility: Contact with strong oxidizing agents creates a fire and explosion risk.

  • Eye and Skin Irritation: Due to its acidic nature, it causes irritation to skin and eyes. Protective equipment is mandatory during use.

  • FDA/EFSA Status: Not suitable for direct food and pharmaceutical applications; only used in indirect medical applications such as contrast agent production.

BEST PRACTICE RECOMMENDATIONS:

  • Storage:

    • Store in a cool, dry, and well-ventilated area.

    • Use moisture-proof, vacuum-sealed, or inert gas (N₂ or Ar) filled containers.

    • Keep away from oxidizing agents.

    • Store at room temperature (15-25°C).

  • Handling:

    • Immediately close containers tightly when not in use.

    • Ensure a dry working environment during use (humidity control).

    • Use a dust mask (N95 or better), protective goggles, and chemically resistant gloves.

    • Avoid dust formation and inhalation.

    • Wash hands thoroughly after handling.

    • When preparing solutions, add slowly due to acidic character.

  • Waste Management:

    • Dispose of in accordance with local regulations as heavy metal waste.

    • Do not discharge into water sources or sewers.

    • For large quantities, rare earth recovery should be considered.

LEGAL DISCLAIMER
This Technical Data Sheet (TDS) is for informational purposes only and has been prepared based on available technical data. The user is solely responsible for determining the suitability of the product for their specific applications and for complying with all local, national, and international regulations. For complete safety, storage, handling, transport, disposal, and regulatory compliance information, the official Safety Data Sheet (SDS/MSDS) provided by the manufacturer/supplier must be consulted. This document does not substitute professional advice. Gadolinium chloride hexahydrate requires careful handling and storage due to its highly hygroscopic nature; it is a critical raw material in the production of MRI contrast agents.

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