Basic information
- CAS
142450-01-9- Standard SMILES
CCCCCCCCCCCCCCCC(O)/C=C/C=O- InChIKey
UHRKFGSEWOTIAN-UHFFFAOYSA-N- Molecular formula
- C19H36O2
- Average molar mass
- 296.5 g/mol
- Monoisotopic mass
- 296.27153039
Names & identifiers
- Preferred name
- 4-Hydroxy-2-nonadecenal
- IUPAC
- (E)-4-hydroxynonadec-2-enal
- English name
- (E)-4-hydroxynonadec-2-enal
- Molecular formula
- C19H36O2
- Molecular weight
- 296.49
Names & synonyms
4-Hydroxy-2-nonadecenal142450-01-9(E)-4-hydroxynonadec-2-enal2-Nonadecenal, 4-hydroxy-
Database identifiers
- CAS
142450-01-9- PubChem CID
- 6366707
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 236
Physicochemical properties
- Boiling point
- 425.538 · 425.538±28.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.896 · 0.896±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.136 · 13.136±0.20(predicted)
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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