Basic information
- CAS
14133-72-3- Standard SMILES
CCCCCCCCC(O)C(CCCCCCCC(=O)O)OC(C)=O- InChIKey
PEHFQVGCCUZNMA-UHFFFAOYSA-N- Molecular formula
- C20H38O5
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.27192431
Names & identifiers
- Preferred name
- 9-(Acetyloxy)-10-hydroxyoctadecanoic acid
- IUPAC
- 9-acetyloxy-10-hydroxyoctadecanoic acid
Names & synonyms
DTXSID10931073NS000518329-(ACETYLOXY)-10-HYDROXYOCTADECANOIC ACID
Database identifiers
- CAS
14133-72-3- PubChem CID
- 85685
- DTXSID
DTXSID10931073
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 18
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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