Basic information
- Standard SMILES
CCC=CCC=CC/C=C\CCCCCCCC(=O)O- InChIKey
DTOSIQBPPRVQHS-NKIRVBODSA-N- Molecular formula
- C18H30O2
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.2245802
Names & identifiers
- Preferred name
- 9,12,15-cis-Octadecatrienoic acid
- IUPAC
- (9Z)-octadeca-9,12,15-trienoic acid
Names & synonyms
SCHEMBL605348DTOSIQBPPRVQHS-NKIRVBODSA-N9,12,15-cis-octadecatrienoic acid
Database identifiers
- PubChem CID
- 445640
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 301
Related reactions
6 records
Compound notes
Loading…