Basic information
- CAS
56554-93-9- Standard SMILES
CC/C=C/CCCCCCCCCCCCCC=O- InChIKey
CTJCPAKVYBLASZ-UHFFFAOYSA-N- Molecular formula
- C18H34O
- Average molar mass
- 266.5 g/mol
- Monoisotopic mass
- 266.2609657
Names & identifiers
- Preferred name
- 15-Octadecenal
- IUPAC
- (E)-octadec-15-enal
- English name
- 15-Octadecenal
- Molecular formula
- C18H34O
- Molecular weight
- 266.46
Names & synonyms
15-Octadecenal56554-93-9(15E)-15-Octadecenal #CTJCPAKVYBLASZ-ONEGZZNKSA-N
Database identifiers
- CAS
56554-93-9- PubChem CID
- 5367672
- Nikkaji
- J110.970G
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 15
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Boiling point
- 356 · 356.0±11.0 °C(Predicted)
- Density
- 0.841 · 0.841±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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