Basic information
- CAS
10322-47-1- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(COC(=O)CCCCCCCCCCC)OCCCCCCCCCCCCCCCC- InChIKey
DITSJCRPKKTEMA-UHFFFAOYSA-N- Molecular formula
- C49H98O4
- Average molar mass
- 751.3 g/mol
- Monoisotopic mass
- 750.7465116
Names & identifiers
- Preferred name
- Dodecanoic acid, 2-(hexadecyloxy)-3-(octadecyloxy)propyl ester
- IUPAC
- (2-hexadecoxy-3-octadecoxypropyl) dodecanoate
- English name
- Dodecanoic acid 2-(hexadecyloxy)-3-(octadecyloxy)propyl ester
- Molecular formula
- C49H98O4
- Molecular weight
- 751.3
Names & synonyms
10322-47-1DTXSID60348334Dodecanoic acid, 2-(hexadecyloxy)-3-(octadecyloxy)propyl esterRefChem:339475DTXCID90299406Dodecanoic acid 2-(hexadecyloxy)-3-(octadecyloxy)propyl ester(2-hexadecoxy-3-octadecoxypropyl) dodecanoate2-(HEXADECYLOXY)-3-(OCTADECYLOXY)PROPYL DODECANOATELauric acid, 2-(hexadecyloxy)-3-(octadecyloxy)propyl esterDITSJCRPKKTEMA-UHFFFAOYSA-N2-(Hexadecyloxy)-3-(octadecyloxy)propyl laurate #Lauric acid 2-(hexadecyloxy)-3-(octadecyloxy)propyl ester
Database identifiers
- CAS
10322-47-1- PubChem CID
- 635296
- DTXSID
DTXSID60348334- Nikkaji
- J111.091H
Properties
Computed structural properties
- XLogP
- 21.6
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 48
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 667
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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