Basic information
- CAS
142449-99-8- Standard SMILES
CCCCCCCCCCCCCC(O)/C=C/C=O- InChIKey
MYCKOWZVADEZNE-UHFFFAOYSA-N- Molecular formula
- C17H32O2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.24023026
Names & identifiers
- Preferred name
- 4-Hydroxy-2-heptadecenal
- IUPAC
- (E)-4-hydroxyheptadec-2-enal
- English name
- 4-Hydroxy-2-heptadecenal
- Molecular formula
- C17H32O2
- Molecular weight
- 268.43
Names & synonyms
4-Hydroxy-2-heptadecenal142449-99-8(E)-4-hydroxyheptadec-2-enal2-Heptadecenal, 4-hydroxy-
Database identifiers
- CAS
142449-99-8- PubChem CID
- 6366705
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 211
Physicochemical properties
- Boiling point
- 397.8 · 397.8±25.0 °C(Predicted)
- Density
- 0.9 · 0.900±0.06 g/cm3(Predicted)
- pka
- 13.14 · 13.14±0.20(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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