Basic information
- CAS
25062-49-1- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCCOCCOCCOC(=O)CCCCCCCCCCCCCCCCC- InChIKey
YBRJTUFWBLSLHY-UHFFFAOYSA-N- Molecular formula
- C42H82O6
- Average molar mass
- 683.1 g/mol
- Monoisotopic mass
- 682.61114033
Overview
The CIR Expert Panel concluded that butylene glycol diisononanoate, cetearyl isononanoate, cetearyl nonanoate, cetyl isononanoate, cholesteryl nonanoate, diethylene glycol diethyl-hexanoate/ diisononanoate, dipentaerythrityl pentaisononanoate, ethylhexyl isononanoate, isodecyl isononanoate, isononyl isononanoate, isotridecyl isononanoate, neopentyl glycol diisononanoate, PEG-2 diisononanoate, PEG-5 isononanoate, pentaerythrityl tetraisononanaote, polyglyceryl-20 octaisononanoate, tridecyl isononanoate, ethylhexyl pelargonate, pentaerythrityl tetrapelargonate, cellobiose octanonanoate, diethylene glycol diisononanoate, dihydrocholesteryl nonanoate, glycereth-7 diisononanoate, isostearyl isononanoate, phytosteryl nonanoate, propylene glycol diisononanoate, ethyl pelargonate, isobutyl pelargonate, methyl pelargonate, neopentyl glycol dicaprylate/dipelargonate/dicaprate, and pelargonic acid are safe as cosmetic ingredients in the present practices of use and concentration described in this safety assessment.
Names & identifiers
- Preferred name
- PEG-3 Distearate
- IUPAC
- 2-[2-(2-octadecanoyloxyethoxy)ethoxy]ethyl octadecanoate
- English name
- ethane-1,2-diylbis(oxyethane-1,2-diyl) distearate
- Molecular formula
- C42H82O6
- Molecular weight
- 683.1
Names & synonyms
25062-49-1PEG-3 DistearateEthane-1,2-diylbis(oxyethane-1,2-diyl) distearateEINECS 246-593-1CUTINA TSPHOENATE 3 DSA8420ECX438NIKKOL ESTEPEARL 30AEC PEG-3 DISTEARATETEGIN D 1102DTXSID90179759Octadecanoic acid, 1,2-ethanediylbis(oxy-2,1-ethanediyl) ester
Show more names
Triglycol distearate1,2-bis-(2-stearoyloxy-ethoxy)-ethaneDistearic acid 1,2-ethanediylbis(oxy-2,1-ethanediyl) esterOctadecanoic acid, 1,1'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)] ester
TRIETHYLENE GLYCOL DISTEARATEOCTADECANOIC ACID, 1,1'-(1,2-ETHANEDIYLBIS(OXY-2,1-ETHANEDIYL)) ESTERRefChem:858965DTXCID00102250PEG-3 DISTEARATE [INCI]246-593-1SCHEMBL8862641UNII-8420ECX438
Database identifiers
- CAS
25062-49-1- PubChem CID
- 90703
- DTXSID
DTXSID90179759- UNII
Properties
Computed structural properties
- XLogP
- 16.5
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 43
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 586
Experimental & physicochemical properties
Cosmetics
Cosmetic ingredients (PEG-3 Distearate) -> CIR (Cosmetic Ingredient Review)
Emulsifying
Physicochemical properties
- FDA UNII
- 8420 ECX438 · 8420ECX438
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (33 of 33) of all reports.
Not Classified
Aggregated GHS information provided per 33 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Octadecanoic acid, 1,2-ethanediylbis(oxy-2,1-ethanediyl) ester
Octadecanoic acid, 1,2-ethanediylbis(oxy-2,1-ethanediyl) ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Toxicology
Toxicity Summary
The CIR Expert Panel concluded that butylene glycol diisononanoate, cetearyl isononanoate, cetearyl nonanoate, cetyl isononanoate, cholesteryl nonanoate, diethylene glycol diethyl-hexanoate/ diisononanoate, dipentaerythrityl pentaisononanoate, ethylhexyl isononanoate, isodecyl isononanoate, isononyl isononanoate, isotridecyl isononanoate, neopentyl glycol diisononanoate, PEG-2 diisononanoate, PEG-5 isononanoate, pentaerythrityl tetraisononanaote, polyglyceryl-20 octaisononanoate, tridecyl isononanoate, ethylhexyl pelargonate, pentaerythrityl tetrapelargonate, cellobiose octanonanoate, diethylene glycol diisononanoate, dihydrocholesteryl nonanoate, glycereth-7 diisononanoate, isostearyl isononanoate, phytosteryl nonanoate, propylene glycol diisononanoate, ethyl pelargonate, isobutyl pelargonate, methyl pelargonate, neopentyl glycol dicaprylate/dipelargonate/dicaprate, and pelargonic acid are safe as cosmetic ingredients in the present practices of use and concentration described in this safety assessment.
Safe for use in cosmetics, with qualifications
Chemistry & industry
Uses & manufacturing
UsesCIR ingredient: PEG-3 Distearate
Use ClassificationCosmetics -> Emulsifying
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…