Basic information
- CAS
13382-52-0- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(COC(C)=O)OC(=O)CCCCCCCCCCCCCCCCC- InChIKey
KAEJGTHBJCWMSD-UHFFFAOYSA-N- Molecular formula
- C41H78O6
- Average molar mass
- 667.1 g/mol
Names & identifiers
- Preferred name
- Glyceryl 1-acetate distearate
- IUPAC
- (3-acetyloxy-2-octadecanoyloxypropyl) octadecanoate
- English name
- distearic acid, diester with glycerol monoacetate
- Molecular formula
- C41H78O6
- Molecular weight
- 667.05442
Names & synonyms
Glyceryl 1-acetate distearate1-Aceto-2,3-distearinAcetin, 2,3-distearo-1Glyceryl distearate 1-acetateStearin, 3-aceto-1,2-di-UNII-2NLQ123OSMGlyceryl 1-acetate-2,3-distearate2NLQ123OSM13382-52-0Octadecanoic acid, 1-((acetyloxy)methyl)-1,2-ethanediyl esterEINECS 247-889-3Distearic acid, diester with glycerol monoacetate
Show more names
SCHEMBL72037352,3-distearoyl-1-acetylglycerol3-ACETO-1,2-DISTEARINKAEJGTHBJCWMSD-UHFFFAOYSA-N26658-07-1Q27255117
Database identifiers
- CAS
13382-52-0、26658-07-1- PubChem CID
- 18175885
- UNII
- 2NLQ123OSM
- EC Number
- 247-889-3
- Nikkaji
- J2.445.569F
Properties
Computed structural properties
- XLogP
- 16.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 40
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 693
Chemistry & industry
Suppliers1 total
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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