Octyldodecyl Stearate
Basic information
- CAS
22766-82-1- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(CCCCCCCC)CCCCCCCCCC- InChIKey
HXVCOQUDJKMJQY-UHFFFAOYSA-N- Molecular formula
- C38H76O2
- Average molar mass
- 565 g/mol
- Monoisotopic mass
- 564.58453166
Overview
The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.
Names & identifiers
- Preferred name
- Octyldodecyl Stearate
- IUPAC
- 2-octyldodecyl octadecanoate
- English name
- 2-octyldodecyl stearate
- Molecular formula
- C38H76O2
- Molecular weight
- 565.01
Names & synonyms
2-Octyldodecyl stearateOctyldodecyl stearate2-Octyl-1-dodecyl stearateStearic acid, 2-octyldodecyl esterOctadecanoic acid, 2-octyldodecyl esterUNII-K6F16QGO28K6F16QGO28CERAPHYL ODSEINECS 245-204-2LOXIOL 3820DTXSID708650672-OCTYLDODECANOL OCTADECANOATE
Show more names
2-Octyldodecylstearat
RefChem:167917DTXCID90813520OCTYLDODECYL STEARATE [INCI]2-octyldodecyl octadecanoate22766-82-1SCHEMBL223228HXVCOQUDJKMJQY-UHFFFAOYSA-NDB-251626
Database identifiers
- CAS
22766-82-1- PubChem CID
- 90834
- DTXSID
DTXSID70865067- UNII
- K6F16QGO28
- EC Number
- 245-204-2
- Nikkaji
- J286.299I
Properties
Computed structural properties
- XLogP
- 18.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 35
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 474
Experimental & physicochemical properties
Cosmetics
Cosmetic ingredients (Octyldodecyl Stearate) -> CIR (Cosmetic Ingredient Review)
Emollient
Physicochemical properties
- Boiling point
- 563.8 · 563.8±18.0 °C(Predicted)
- Density
- 0.856 · 0.856±0.06 g/cm3(Predicted)
- refractive index
- 1.457 · 1.457
- form
- oily liquid
- color
- Colorless
- Odor
- Mild, characteristic odor
- Cosmetics Ingredients Functions
- SKIN CONDITIONING - EMOLLIENT
- LogP
- 17.952 · 17.952 (est)
- FDA UNII
- 6 F16QGO28 · K6F16QGO28
- EPA Substance Registry System
- 2 · 2-Octyldodecyl stearate (22766-82-1)
- TSCA
- TSCA listed
- HS Code
- 2915709000 · 2915709000
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% (48 of 48) of all reports.
Not Classified
Aggregated GHS information provided per 48 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Octadecanoic acid, 2-octyldodecyl ester
Octadecanoic acid, 2-octyldodecyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Octadecanoic acid, 2-octyldodecyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Toxicology
Toxicity Summary
The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.
Safe for use in cosmetics, with qualifications
Safety data
- tsca
- TSCA listed
- hs_code
- 2915709000
Chemistry & industry
Uses & manufacturing
UsesCIR ingredient: Octyldodecyl Stearate
Use ClassificationCosmetics -> Emollient
General Manufacturing InformationOctadecanoic acid, 2-octyldodecyl ester: ACTIVE
Applications
UsesOctyldodecyl Stearate is a versatile ester commonly used in the cosmetics and personal care industries due to its excellent emollient and skin-conditioning properties.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…