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PEG 400 Oleate, Polyethylene Glycol 400 Oleate, 9004-96-0

PEG 400 Oleate, Polyethylene Glycol 400 Oleate, 9004-96-0

POLYETHYLENE GLYCOL 400 OLEATE (PEG 400 OLEATE)

1. Chemical Identity and Material Classification

  • Chemical Name: Polyethylene Glycol 400 Oleate, PEG 400 Monooleate, Polyoxyethylene (8) Oleate (approximate EO count)

  • Synonyms: PEG 400 Oleate, Polyethylene Glycol Monooleate (n≈8-9), PEG Monooleate (MW ~400), PEG-8 Oleate (approximate)

  • CAS Number: 9004-96-0

  • EC Number (EINECS): 500-016-2 / 253-134-9

  • Molecular Formula: C₂₀H₃₈O₅ (representative; actual is polymeric)

  • Molecular Weight: ~742 g/mol (approximate; depends on degree of polymerization)

  • Chemical Class: Non-ionic surfactant (ester)

  • UN Number: Not classified as hazardous for transport

2. Raw Materials: Polyethylene Glycol 400 and Oleic Acid

2.1 Polyethylene Glycol 400 (PEG 400)

Parameter Value
CAS Number 25322-68-3
Molecular Formula HO(C₂H₄O)ₙH
Average molecular weight 380–420 g/mol
Average EO units (n) 8–9
Appearance Clear, colorless viscous liquid

PEG 400 is produced by polymerization of ethylene oxide with water, monoethylene glycol, or diethylene glycol.

2.2 Oleic Acid

Parameter Value
CAS Number 112-80-1
Molecular Formula C₁₈H₃₄O₂
Chain C18:1 (monounsaturated)
Source Vegetable oils (olive, sunflower) or tallow

3. Physical Properties

3.1 General Physical Properties

Property Value
Appearance Clear to pale yellow to amber viscous liquid
Physical state (20°C) Liquid (viscous)
Odor Mild fatty, characteristic odor
Color (APHA) ≤ 100 (yellow to amber)
Density (25°C) ~1.01 g/cm³ (1.00–1.05)
Viscosity (25°C) 200–400 cP (viscous)
Refractive index (nD25) 1.470–1.475
Melting point Not applicable (liquid at room temperature)
Boiling point ~100°C (decomposes)
Flash point >200°C (non-flammable)
Vapor pressure Negligible
HLB (Hydrophilic-Lipophilic Balance) ~11–12 (oil-in-water emulsifier)

3.2 Solubility

Solvent Solubility
Water Soluble (dispersible)
Ethanol Soluble
Isopropanol Soluble
Mineral oil Soluble
Vegetable oils Soluble
Acetone Soluble
Aliphatic hydrocarbons Partially soluble
Aromatic hydrocarbons Soluble

4. Chemical Properties

4.1 Molecular Structure

PEG 400 Oleate is an ester formed by the reaction of:

  • Polyethylene Glycol 400 (hydrophilic head – polyether chain)

  • Oleic Acid (hydrophobic tail – C18 unsaturated fatty acid)

Structure: CH₃(CH₂)₇CH=CH(CH₂)₇COO-(CH₂CH₂O)ₙH (where n ≈ 8–9)

4.2 Production Method

Reaction: Oleic acid + PEG 400 → PEG 400 Oleate + H₂O

Process:

  1. Oleic acid and PEG 400 are reacted under heat (150–200°C)

  2. Acid catalyst (e.g., p-toluenesulfonic acid) or enzymatic catalyst may be used

  3. Water is removed to drive reaction to completion

  4. Product is purified, neutralized, and filtered

Typical conversion: >95% esterification

4.3 Key Functional Properties

Property Description
HLB value ~11–12 – suitable for oil-in-water (O/W) emulsions
Surfactant type Non-ionic – compatible with anionic, cationic, and other non-ionic surfactants
Emulsification Excellent for oils, fats, and waxes
Solubilization Solubilizes essential oils and fragrances
Wetting agent Reduces surface tension
Dispersant Stabilizes pigment and particle dispersions
Lubricity Provides lubricating properties
Humectant Retains moisture (PEG component)
Biodegradability Readily biodegradable

5. Quality Specifications

5.1 Typical Specifications (Commercial Grade)

Parameter Specification Test Method
Appearance Clear to pale yellow to amber viscous liquid Visual
Color (APHA) ≤ 100 Visual
Odor Mild fatty odor Organoleptic
Acid value ≤ 3–10 mg KOH/g (depending on grade) Titration
Saponification value 60–80 mg KOH/g Titration
Hydroxyl value 50–70 mg KOH/g Titration
Water content (K. Fischer) ≤ 0.5% Karl Fischer
pH (5% aqueous solution) 5.0–7.0 (neutral to slightly acidic) pH meter
Viscosity (25°C) 200–400 cP Brookfield
Density (25°C) 1.00–1.05 g/cm³ Hydrometer
HLB 11–12 Calculated
Cloud point Not applicable (soluble)
Peroxide value ≤ 5 meq/kg Titration
Heavy metals (as Pb) ≤ 10 ppm ICP-OES

5.2 Typical Specifications (Cosmetic Grade)

Parameter Specification
Purity ≥ 98%
Residual PEG 400 ≤ 3%
Residual oleic acid ≤ 2%
Dioxane content (by-product) ≤ 5 ppm (for cosmetic use)
Ethylene oxide (residual) ≤ 1 ppm
Heavy metals ≤ 5 ppm
Microbial limits ≤ 100 CFU/g (total count)
Preservative None (self-preserving due to low water activity)

6. Industrial Applications

6.1 Cosmetics and Personal Care (Primary Application)

Application Function Typical Concentration
Creams and lotions Emulsifier (O/W), stabilizer 1–5%
Shampoos and conditioners Emollient, lubricant, detangler 0.5–3%
Facial cleansers Solubilizer, mild surfactant 1–5%
Body washes Foam booster, emollient 1–3%
Makeup removers Solubilizes oils and makeup 2–10%
Sunscreens Emulsifier, dispersant 1–4%
Hair oils Lubricant, shine enhancer 0.5–2%
Shaving creams Lubricant, foam stabilizer 1–3%

Benefits in cosmetics:

  • Mild to skin (non-ionic, low irritation)

  • Moisturizing (PEG component retains water)

  • Enhances product spreadability

  • Stable across wide pH range (4–9)

6.2 Pharmaceutical Applications

Application Function Typical Concentration
Topical creams and ointments Emulsifier, penetration enhancer 1–10%
Oral liquid formulations Solubilizer, taste-masking 0.5–5%
Suppositories Emulsifier, release modifier 1–5%
Transdermal patches Penetration enhancer Variable
Vaccine adjuvants Emulsifier in oil-in-water emulsions 1–5%

6.3 Industrial and Institutional Cleaners

Application Function Typical Concentration
Industrial degreasers Emulsifies oils and greases 1–10%
Metal cleaning Wetting agent, emulsifier 0.5–5%
Hard surface cleaners Wetting, soil suspension 0.5–3%
Car wash formulations Emulsifier, foam booster 1–5%
Engine degreasers Oil solubilizer 2–10%

6.4 Textile Industry

Application Function
Fiber lubricant Reduces friction during processing
Antistatic agent Reduces static charge
Knitting oils Lubricant
Dyeing auxiliaries Dispersant, leveling agent
Fabric softeners Emulsifier, softener

6.5 Plastic and Polymer Industry

Application Function
Internal lubricant Improves melt flow, reduces torque
External lubricant Mold release agent
Antistatic agent Reduces surface resistivity
Dispersant for pigments Improves color distribution
Plasticizer Increases flexibility (minor use)
Stabilizer Heat stabilizer co-agent

6.6 Paints, Coatings, and Inks

Application Function
Pigment dispersant Stabilizes pigment suspensions
Wetting agent Improves substrate wetting
Leveling agent Improves flow and leveling
Defoamer Reduces foam (at higher concentrations)
Flexographic inks Solvent for basic dyes

6.7 Food Industry (Limited – Check local regulations)

Application Function
Emulsifier in processed foods Oil-in-water emulsifier
Bakery products Dough conditioner
Beverage emulsions Flavor oil solubilizer
Dairy analogs Emulsion stabilizer

Note: Food-grade product required; verify local regulatory approval.

6.8 Agriculture

Application Function
Pesticide emulsifier Emulsifies pesticide concentrates
Adjuvant Improves wetting and penetration
Fertilizer additive Dispersant

7. Comparison with Other PEG Esters

Property PEG 400 Oleate PEG 400 Stearate PEG 400 Laurate PEG 400 Dioleate
Fatty acid Oleic (C18:1) Stearic (C18:0) Lauric (C12:0) Oleic (C18:1)
HLB ~11–12 ~11–12 ~14–15 ~6–8
Form at 20°C Liquid Paste/solid Liquid Liquid
Unsaturation Yes No No Yes
Emulsion type O/W O/W O/W W/O
Primary use Cosmetics, emulsifier Creams, lotions Detergents W/O emulsifier

8. Safety and Toxicology

8.1 Acute Toxicity

Parameter Value
Oral LD₅₀ (rat) >5,000 mg/kg (low toxicity)
Dermal LD₅₀ (rabbit) >2,000 mg/kg
Skin irritation Mild irritant (may cause mild irritation with prolonged contact)
Eye irritation Mild to moderate irritant
Skin sensitization Generally non-sensitizer
Inhalation Not expected to be hazardous (low vapor pressure)

8.2 Special Concerns

Concern Information
Dioxane (1,4-dioxane) contamination Trace amounts may be present as by-product of ethoxylation; cosmetic grades are purified to ≤5 ppm
Ethylene oxide residue Residual EO may be present at trace levels (<1 ppm in purified grades)
Biodegradability Readily biodegradable
Aquatic toxicity Low to moderate

8.3 GHS Classification (Typical)

Classification Category
Signal word None (not classified as hazardous for most grades)
Hazard statements None (for pure product)
Precautionary statements P264, P280, P302+P352, P305+P351+P338, P332+P313, P337+P313

8.4 Dioxane Concern – Important Note

PEG-based surfactants (including PEG 400 Oleate) may contain trace amounts of 1,4-dioxane, a potential human carcinogen (IARC Group 2B – possibly carcinogenic to humans).

Regulatory limits:

  • US FDA: Not specified (but manufacturers use vacuum stripping to reduce levels)

  • EU Cosmetic Regulation: Not specified, but good manufacturing practices require minimization

  • Cosmetic grade: Typically ≤5 ppm 1,4-dioxane

  • Pharmaceutical grade: Typically ≤10 ppm (USP) or as specified

9. GHS Classification

Classification Category
Signal word None (not hazardous per CLP for most grades)
Hazard statements None (under normal conditions)
Precautionary statements P264, P280, P302+P352, P305+P351+P338, P332+P313, P337+P313

10. First Aid Measures

Exposure Route Action
Eye contact Rinse with plenty of water for 15 minutes; seek medical attention if irritation persists
Skin contact Wash with soap and water; remove contaminated clothing
Inhalation Remove to fresh air (unlikely due to low vapor pressure)
Ingestion Rinse mouth; do NOT induce vomiting; drink water; seek medical attention if large amount swallowed

11. Environmental Fate

Parameter Value
Biodegradability Readily biodegradable (OECD 301)
Aquatic toxicity (fish, LC₅₀, 96 hours) 10–100 mg/L (low to moderate)
Daphnia magna (EC₅₀, 48 hours) 10–100 mg/L
Bioaccumulation Low potential

12. Storage and Handling

12.1 Handling Precautions

Parameter Recommendation
Ventilation Adequate ventilation; no special requirements
Personal hygiene Wash hands after handling
Spill response Absorb with inert material; collect in sealed containers

12.2 Storage Conditions

Parameter Requirement
Temperature 5–40°C (room temperature)
Container Keep tightly closed in original container (HDPE, stainless steel, or lined steel)
Protect from Moisture (hygroscopic to some extent), extreme heat, strong oxidizing agents
Environment Cool, dry, well-ventilated area
Shelf life (unopened) 24 months
Shelf life (opened) 12 months (if protected from contamination)

Degradation indicators:

  • Acid value increase (hydrolysis – free fatty acid formation)

  • Color darkening

  • Peroxide value increase (oxidation of oleate double bond)

12.3 Container Materials

Container Type Suitability
HDPE (High-Density Polyethylene) Suitable
Polypropylene Suitable
Stainless steel (304, 316) Suitable
Glass Suitable
Carbon steel Suitable (dry conditions)
Aluminum Suitable
Copper Not recommended (may catalyze oxidation)

13. Transport Information

Regulation Classification
UN Number Not regulated
ADR/RID Not classified as dangerous goods
IMDG Not regulated
IATA Not regulated
Proper shipping name Polyethylene glycol oleate (non-hazardous)

14. Synonyms and Common Names

  • English: PEG 400 Oleate, Polyethylene Glycol 400 Monooleate, PEG-8 Oleate (approx.), Polyoxyethylene (8) Monooleate, PEG 400 Monooleate, Macrogol Oleate

  • Trade names: Eumulgin O 8, Kessco PEG 400 MO, Lipopeg 400 MO, Nikkol MYO-8, Protachem 400-MO, Tegin O 85, Varonic 400 MO

  • French: Oléate de polyéthylène glycol 400

  • German: Polyethylenglykol 400 oleat

  • Spanish: Oleato de polietilenglicol 400

  • Turkish: Polietilen Glikol 400 Oleat, PEG 400 Oleat

15. Regulatory Status

Regulation Status
REACH (EU) Registered
TSCA (US) Listed
FDA Permitted for food contact and as indirect food additive (21 CFR) – specific applications
EU Cosmetics Regulation (EC 1223/2009) Permitted as emulsifier
RoHS Compliant

16. Why Choose PEG 400 Oleate?

Advantage Description
Excellent emulsifier Forms stable oil-in-water (O/W) emulsions
Non-ionic surfactant Compatible with all surfactant types (anionic, cationic, amphoteric)
Wide pH stability Stable from pH 4–9
Mild to skin Low irritation potential – suitable for sensitive skin formulations
Moisturizing properties PEG component acts as humectant
Biodegradable Environmentally friendly
Low toxicity Safe for cosmetic and pharmaceutical use
Liquid at room temperature Easy to handle and incorporate
Versatile Multiple applications across industries
Good solubilizer Solubilizes oils, fragrances, and active ingredients

Limitations:

  • Potential 1,4-dioxane contamination – requires purification for cosmetic/pharmaceutical grades

  • May cause mild irritation at high concentrations

  • Oxidation susceptibility – oleate double bond may oxidize over time (add antioxidants for long-term stability)

  • High viscosity – may require warming for easier handling in cold climates

17. Typical Formulations

17.1 O/W Cream (Cosmetic)

Component % w/w
PEG 400 Oleate 2.0
Cetearyl alcohol 2.0
Mineral oil 5.0
Glycerin 3.0
Preservative qs
Water to 100

17.2 Industrial Degreaser Concentrate

Component % w/w
PEG 400 Oleate 5.0
Sodium metasilicate 5.0
Sodium carbonate 5.0
Non-ionic surfactant blend 10.0
Water to 100

18. Storage Stability and Shelf Life

Parameter Value
Shelf life (unopened) 24 months (proper storage)
Shelf life (opened) 12 months (if protected from contamination)
Storage temperature 5–40°C
Stability Stable; avoid extreme heat, strong oxidizing agents

Degradation indicators:

  • Increase in acid value (hydrolysis)

  • Color darkening (oxidation)

  • Peroxide value increase

19. PEG 400 Oleate vs. Other PEG Esters – Selection Guide

HLB Range PEG Ester Application
2–6 PEG 400 Dioleate W/O emulsifier, antifoam
8–10 PEG 400 Monolaurate Detergents, wetting agents
11–12 PEG 400 Monooleate O/W emulsifier, cosmetics
11–12 PEG 400 Monostearate Creams, lotions
14–15 PEG 400 Dilaurate Detergents, solubilizers
16–18 PEG 40 Stearate High HLB emulsifier, solubilizer

20. Summary Table – Key Specifications at a Glance

Parameter Value
Product Name Polyethylene Glycol 400 Oleate (PEG 400 Oleate)
CAS Number 9004-96-0
EC Number 500-016-2 / 253-134-9
Appearance Clear to pale yellow to amber viscous liquid
Odor Mild fatty
Density (25°C) ~1.01 g/cm³
Viscosity (25°C) 200–400 cP
Acid Value ≤ 3–10 mg KOH/g
Saponification Value 60–80 mg KOH/g
HLB ~11–12
Water Solubility Soluble
Flash Point >200°C
Primary Applications Cosmetics (emulsifier), pharmaceuticals (emulsifier), industrial cleaners, textiles, plastics
Biodegradability Readily biodegradable
GHS Signal Word None (non-hazardous for most grades)

This TDS is prepared in compliance with ISO 11014-1 format and is intended for cosmetic formulators, pharmaceutical scientists, industrial cleaning formulators, textile chemists, and procurement professionals. Certificates of Analysis (CoA), Safety Data Sheets (SDS), and sample validation reports are available upon request.

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