(9Z,12E,15Z)-octadeca-9,12,15-trienal
Basic information
- CAS
26537-71-3- Standard SMILES
CC/C=C\C/C=C/C/C=C\CCCCCCCC=O- InChIKey
TUCMDDWTBVMRTP-PCMISOECSA-N- Molecular formula
- C18H30O
- Average molar mass
- 262.4 g/mol
- Monoisotopic mass
- 262.22966558
Names & identifiers
- Preferred name
- (9Z,12E,15Z)-octadeca-9,12,15-trienal
- IUPAC
- (9Z,12E,15Z)-octadeca-9,12,15-trienal
Database identifiers
- CAS
26537-71-3- PubChem CID
- 6433993
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 261
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Compound notes
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