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Propylene Glycol n-Butyl Ether, 3-Butoxypropan-2-ol, PNB, PGBE, 5131-66-8

Propylene Glycol n-Butyl Ether, 3-Butoxypropan-2-ol, PNB, PGBE, 5131-66-8

Product Name: Propylene Glycol n-Butyl Ether (PNB)
Chemical Name: 1-Butoxypropan-2-ol
CAS No: 5131-66-8
EC No (EINECS): 225-878-4
Chemical Formula: C₇H₁₆O₂
Molecular Weight: 132.20 g/mol
REACH Status: Registered

1. PRODUCT DESCRIPTION AND CHEMICAL IDENTITY

Parameter Description
Chemical Name (IUPAC) 1-Butoxypropan-2-ol
Other Names Propylene Glycol n-Butyl Ether, PNB, Propylene Glycol n-Butyl Ether, PGBE, 3-Butoxypropan-2-ol, Dowanol® PnB
CAS Number 5131-66-8
EC Number (EINECS) 225-878-4
Molecular Formula C₇H₁₆O₂
Molecular Weight 132.20 g/mol
Chemical Class Glycol ether, alcohol-ether, secondary alcohol
Appearance Colorless liquid
Odor Mild ethereal
Taste Not determined as technical product
REACH Status Registered

CHEMICAL STRUCTURE AND DESCRIPTION:

Propylene Glycol n-Butyl Ether (PNB) is a glycol ether. Its structure contains both an ether (-O-) group and a hydroxyl (-OH) group. It also contains an n-butyl chain. This structure gives PNB both hydrophilic (water-loving) and lipophilic (oil-loving) character. This balance makes it compatible with many polar and non-polar solvents.

Structural Formula (Open Structure):

CH₃-CH₂-CH₂-CH₂-O-CH₂-CH(OH)-CH₃

(1-Butoxypropan-2-ol)

PNB is generally found as a mixture of isomers. Commercial PNB is the n-butyl ether of propylene glycol, with the main component being 1-butoxy-2-propanol. The isomers arise from different modes of attachment of the propylene oxide chain.

These structural features:

Give PNB excellent solvent properties.

Provide miscibility with water and organic solvents.

Offer moderate volatility and a controlled evaporation profile.

Find wide use in coatings, cleaners, and chemical formulations.

PNB is a glycol ether solvent with moderate volatility and excellent solvency for both polar and non-polar substances. It is widely used in paints, inks, varnishes, cleaning products, agricultural chemicals, and electronic cleaning solutions.

2. PHYSICAL AND CHEMICAL PROPERTIES

Property Value
Molecular Formula C₇H₁₆O₂
Molecular Weight 132.20 g/mol
Appearance Colorless liquid
Odor Mild ethereal
Density 0.88 g/cm³ (20 °C)
Boiling Point ~171 °C
Flash Point 63–65 °C (closed cup)
Vapor Pressure 0.35 kPa (20 °C)
Viscosity ~2.5 mPa·s (20 °C)
Surface Tension ~27 mN/m (20 °C)
Refractive Index ~1.41 (20 °C)
Solubility Miscible with water, compatible with organic solvents
Stability Stable under recommended storage conditions
pH (aqueous solution) Near neutral
Volatility Moderate
Hygroscopicity May absorb slight moisture; store in dry conditions

PNB is a colorless liquid. Its boiling point is ~171 °C. Its flash point is 63–65 °C (closed cup). Its density is about 0.88 g/cm³. Its vapor pressure is 0.35 kPa at 20 °C. It is miscible with water and most organic solvents. It has moderate volatility and offers a controlled evaporation profile.

3. SOLUBILITY PROFILE

Solvent Solubility Conditions
Water Miscible 20 °C
Methanol Miscible -
Ethanol Miscible -
Isopropanol Miscible -
Acetone Miscible -
Ethyl acetate Miscible -
Hexane Limited / partially soluble -
Toluene Miscible -
Xylene Miscible -
Glycols Miscible -

PNB is miscible with a wide range of polar and non-polar solvents. It is completely miscible with water. This property makes it useful in both water-based and solvent-based formulations.

4. CHEMICAL PROPERTIES AND REACTIONS

Property Description
Chemical Class Glycol ether, secondary alcohol
Reactivity Esterification, transesterification, urethane formation, etherification
Hydrolytic Stability High
Thermal Stability Good
Oxidation Resistance Moderate
Polymerization Does not undergo hazardous spontaneous polymerization
Compatibility Carboxylic acids, anhydrides, isocyanates, esters
Substances to Avoid Strong oxidizing agents, strong acids, strong bases
Hazardous Decomposition Products Carbon monoxide (CO), carbon dioxide (CO₂), aldehydes, and organic vapors

Thanks to the hydroxyl group in its structure, PNB can undergo esterification, transesterification, and urethane formation reactions. The ether group enhances its solvent properties. PNB is generally used as a solvent; however, it can also participate in reactions as a chemical intermediate.

5. SPECIFICATIONS (TECHNICAL/INDUSTRIAL GRADE)

Parameter Specification
Purity (GC) ≥ 99.0%
Appearance Colorless liquid
Color (Pt-Co) ≤ 10 Hazen
Water Content ≤ 0.1%
Acid Value ≤ 0.01 mg KOH/g
Density (20 °C) 0.875–0.885 g/cm³
Boiling Range 168–174 °C
Flash Point ≥ 63 °C
Refractive Index (20 °C) 1.405–1.415
Viscosity (20 °C) 2.0–3.0 mPa·s
Heavy Metals ≤ 10 ppm
Shelf Life 24 months (under proper storage)

PNB is produced in technical grade with high purity. In industrial applications, batch-to-batch consistency, color stability, and low impurity content are important. High purity is particularly preferred in coating, cleaning, and electronic applications.

6. APPLICATIONS AND INDUSTRIAL USES

6.1. Cleaning Products

Application Description
Industrial Cleaners Dissolves oils, dirt, and residues
Household Cleaners Used as a solvent in surface cleaners
Metal Cleaners Dissolves oils and dirt on metal surfaces
Surface Preparation Surface cleaning before painting and coating

Thanks to its strong solvency power and miscibility with water, PNB is an effective solvent in cleaning products.

6.2. Coating and Paint Solvents

Application Description
Water-Based Paints Acts as a coalescent solvent, improving film formation
Solvent-Based Paints Solvent and viscosity modifier
Varnishes Improves gloss and surface quality
Industrial Coatings Solvent and flow modifier

PNB is a widely used solvent in water-based and solvent-based coatings.

6.3. Ink and Adhesive Formulations

Application Description
Inks Solvent and viscosity modifier
Adhesives Solvent and adhesion promoter
Printing Inks Solvent and flow modifier

PNB is used as a solvent in ink and adhesive formulations.

6.4. Metal Cleaners and Surface Preparation

Application Description
Metal Cleaners Dissolves oil, rust, and residues
Surface Preparation Surface cleaning before painting
Industrial Maintenance Cleaning of machinery and equipment

PNB is used as a solvent in metal cleaners and surface preparation processes.

6.5. Other Applications

Application Description
Electronic Cleaners Used in photoresist and semiconductor cleaning
Agricultural Chemicals Used as a carrier solvent
Cosmetics Used as a solvent in some cosmetic products

7. STRUCTURAL AND FUNCTIONAL PROPERTIES

Property Description
Structural Class Glycol ether, secondary alcohol
Functional Groups Ether (-O-) and hydroxyl (-OH)
Amphiphilic Character Both hydrophilic and lipophilic
Solvency Power High
Evaporation Profile Moderate, controlled
Water Miscibility Completely miscible
Polarity Medium polarity
Polymer Contribution Solvent, coalescent, viscosity modifier

The amphiphilic structure of PNB makes it effective in both water-based and solvent-based systems. The ether group increases solvency power, while the hydroxyl group provides miscibility with water. The n-butyl chain enhances lipophilic character.

8. INDUSTRIAL PROCESSES AND TECHNICAL APPLICATIONS

Application Description
Coalescent Solvent Improves film formation in water-based paints
Solvent Formulation Used as a solvent in cleaners and coatings
Extraction Solvent in chemical extraction processes
Reaction Medium Provides solvent medium in chemical reactions
Cleaning Used in industrial and electronic cleaning
Carrier Solvent Carrier in pesticide and agricultural chemicals

9. SAFETY AND TOXICOLOGY

Parameter Value
GHS Classification Flam. Liq. 3 (H226), Skin Irrit. 2 (H315), Eye Irrit. 2A (H319), STOT SE 3 (H336)
Oral LD50 (Rat) > 5000 mg/kg
Dermal LD50 (Rabbit) > 5000 mg/kg
Skin Irritation Causes skin irritation (H315)
Eye Irritation Causes serious eye irritation (H319)
Respiratory Irritation Vapor inhalation may cause drowsiness or dizziness (H336)
Skin Sensitization Not expected
Mutagenicity Not classified
Carcinogenicity Not classified
Bioaccumulation Not likely
WGK Germany 1 (slightly hazardous to water)

PNB is a chemical with low toxicity. It may cause irritation on contact with eyes and skin. Vapor inhalation may cause drowsiness or dizziness. Prolonged and repeated skin contact should be avoided. It is classified as a flammable liquid.

10. TRANSPORT INFORMATION

Parameter Information
UN Number UN 1993 (Flammable liquid, n.o.s.)
Hazard Class 3 (Flammable liquids)
Packing Group III
Proper Shipping Name Flammable liquid, n.o.s. (Propylene Glycol n-Butyl Ether)
Marine Pollutant No
ADR/RID Label Class 3
Transport Regulations Must be transported in accordance with ADR/RID/IMDG/IATA rules

PNB is classified as a flammable liquid. Transport by sea, land, or air must comply with ADR/RID/IMDG/IATA regulations.

11. REGULATORY INFORMATION

Region Status
EU REACH registered
USA (TSCA) Listed
EINECS 225-878-4
Turkey (KKDİK) Should be evaluated within compliance and registration requirements
Food Contact Not suitable for technical grade; special grade required for food contact
Hazardous Substance Yes (flammable liquid)

12. STORAGE AND HANDLING

Parameter Information
Storage Conditions Store in a cool, dry, well-ventilated area
Temperature 15–25 °C
Container Requirements Closed containers, away from moisture and heat sources
Moisture Control Dry environment to prevent moisture absorption
Substances to Avoid Strong oxidizing agents, direct sunlight, ignition sources
Shelf Life 24 months (under proper storage)
Handling Notes Avoid breathing vapor; use PPE
Packaging Options 200 L steel drums, IBC tanks, bulk delivery; custom packaging upon request

Handling Notes:

Avoid breathing vapor.

Use appropriate personal protective equipment (gloves, goggles, mask).

Avoid contact with skin and eyes.

Keep away from ignition sources.

13. FIRE-FIGHTING MEASURES

Parameter Information
Fire Hazard Flammable liquid; vapor/air mixture may be flammable
Flash Point 63–65 °C (closed cup)
Extinguishing Media Water spray, foam, CO₂, dry chemical powder
Special Hazards Thermal decomposition may release CO, CO₂, and organic vapors
Protective Equipment Self-contained breathing apparatus (SCBA), full protective clothing

PNB is a flammable liquid. In case of fire, appropriate extinguishing media should be used, and firefighting personnel should wear protective equipment.

14. ACCIDENTAL RELEASE MEASURES

Parameter Information
Personal Protection Respirator, protective goggles, gloves, protective clothing
Ventilation Ventilate the area
Containment Contain the spill
Cleaning Methods Absorb with inert material; place in suitable disposal container
Environmental Precautions Prevent entry into drains, sewers, and water sources
Waste Disposal Dispose of according to local regulations

In case of a spill, clean up while preventing vapor formation. Dispose of waste properly. Prevent environmental release.

15. FIRST AID MEASURES

Exposure Route Action
Inhalation Move to fresh air; seek medical attention if symptoms persist
Skin Contact Wash with plenty of water; seek medical attention if irritation persists
Eye Contact Rinse with water for at least 15 minutes; remove contact lenses if present
Ingestion Do not induce vomiting; seek immediate medical attention

16. RAW MATERIALS AND BY-PRODUCTS

16.1. Raw Materials (Upstream)

Raw Material Description
Propylene Oxide Precursor in PNB synthesis
n-Butanol Used in etherification reaction
Propylene Glycol Intermediate

16.2. By-Products (Downstream)

By-Product Application
PNB Esters Solvent, plasticizer
PNB Acetate Coating and cleaning solvent
Polyurethanes Adhesives, elastomers
Resins Coatings, adhesives

17. INDUSTRY SUITABILITY AND USE LEVELS

Industry Application Area Example Use Suitability
Cleaning Solvent Industrial and household cleaners High
Coatings Solvent, coalescent Water-based paints, inks High
Ink and Adhesive Solvent Printing inks, adhesives High
Metal Cleaning Solvent Metal cleaners, surface preparation High
Electronics Cleaning solvent Photoresist, semiconductor Suitable
Agriculture Carrier solvent Pesticide formulations Suitable

18. CHEMICAL REACTIONS AND DERIVATIVE CHEMISTRY

PNB can undergo many chemical reactions due to its hydroxyl group:

Reaction Description
Esterification Forms esters with carboxylic acids
Transesterification Reacts with esters to perform ester exchange
Urethane Formation Forms polyurethanes with isocyanates
Etherification Can form ether bonds under suitable conditions
Acetylation Forms PNB acetate derivative with acetic acid

PNB derivatives are widely used in coatings, cleaners, and polymer systems.

19. DERIVATIVES AND RELATED COMPOUNDS

Compound Description
PNB Acetate Coating and cleaning solvent
PNB Esters Plasticizer and solvent
Propylene Glycol Intermediate in PNB production
Propylene Glycol Methyl Ether (PM) Similar glycol ether solvent
Dipropylene Glycol n-Butyl Ether (DPnB) Similar glycol ether solvent
Ethylene Glycol n-Butyl Ether (EB) Similar glycol ether solvent

20. SUMMARY AND IMPORTANT PRECAUTIONS

SUMMARY:
Propylene Glycol n-Butyl Ether (PNB) is a colorless glycol ether solvent with the formula C₇H₁₆O₂ and CAS number 5131-66-8. It has moderate volatility and excellent solvency for both polar and non-polar substances. It is miscible with water and most organic solvents. It is widely used in cleaning products, coating and paint solvents, ink and adhesive formulations, metal cleaners, and surface preparation. Thanks to its amphiphilic character, it is effective in a wide range of formulations. It has low toxicity; however, it is classified as a flammable liquid. It should be stored in a cool, dry, and well-ventilated area in tightly closed containers.

Key Properties:

Property Value
Appearance Colorless liquid
Chemical Formula C₇H₁₆O₂
Molecular Weight 132.20 g/mol
CAS Number 5131-66-8
Boiling Point ~171 °C
Flash Point 63–65 °C (closed cup)
Density 0.88 g/cm³ (20 °C)
Vapor Pressure 0.35 kPa (20 °C)
Solubility Water and most organic solvents
Chemical Class Glycol ether, secondary alcohol
Primary Use Solvent, cleaner, coating solvent

Main Applications:

Industry Applications
Cleaning Products Industrial and household cleaners
Coatings Water-based paints, inks, varnishes
Ink and Adhesive Printing inks, adhesives
Metal Cleaning Metal cleaners, surface preparation
Electronics Photoresist, semiconductor cleaning
Agriculture Pesticide formulations

Key Safety Points:

FLAMMABLE LIQUID: Flam. Liq. 3 (H226)

SKIN IRRITATION: Skin Irrit. 2 (H315)

EYE IRRITATION: Eye Irrit. 2A (H319)

RESPIRATORY: STOT SE 3 (H336) – drowsiness or dizziness

STORAGE: 15–25 °C, cool, dry, well-ventilated

PPE RECOMMENDED: Gloves, protective goggles, respirator

INCOMPATIBLE: Strong oxidizing agents, ignition sources

CRITICAL WARNINGS:

PNB is a glycol ether containing both an ether and a hydroxyl group. This structure gives it amphiphilic character.

It is miscible with water and most organic solvents, making it useful in a wide range of formulations.

It acts as a coalescent solvent in water-based paints, improving film formation.

It is used as a strong solvent in industrial and household cleaners.

It is effective in metal cleaners and surface preparation processes.

It serves as a solvent in ink and adhesive formulations.

It is a flammable liquid; it should be kept away from ignition sources.

It is classified as a hazardous substance; appropriate PPE should be used in industrial handling.

Vapor inhalation may cause drowsiness or dizziness; good ventilation should be provided.

It should be stored in tightly closed containers to prevent moisture absorption.

Important Statement: 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 own specific applications and for complying with all applicable regulations and safety requirements. For complete safety, use, storage, and regulatory compliance information, always refer to the official Safety Data Sheet (SDS/MSDS) provided by the manufacturer/supplier. Users are obligated to test the product in their own processes and applications. All local, national, and international regulations must be followed when working with PNB.

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