Basic information
- CAS
38285-42-6- Standard SMILES
CCCCCC=CC(C)O- InChIKey
YNVSGIMVJYMXHH-UHFFFAOYSA-N- Molecular formula
- C9H18O
- Average molar mass
- 142.24 g/mol
- Monoisotopic mass
- 142.1357652
Names & identifiers
- Preferred name
- 3-Nonen-2-ol
- IUPAC
- non-3-en-2-ol
- English name
- (E)-3-Nonen-2-ol
- Molecular formula
- C9H18O
- Molecular weight
- 142.24
Names & synonyms
3-Nonen-2-olNon-3-en-2-ol38285-42-6SCHEMBL811613SCHEMBL7549443SCHEMBL8436114DTXSID809592093-Nonen-2-ol, (3E)-(E)-3-Nonen-2-ol
Database identifiers
- CAS
38285-42-6- PubChem CID
- 556867
- DTXSID
DTXSID80959209
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 86.7
Physicochemical properties
- Boiling point
- 197.4 · 197.4±8.0 °C(Predicted)
- Density
- 0.843 · 0.843±0.06 g/cm3(Predicted)
- pka
- 14.56 · 14.56±0.20(Predicted)
- LogP
- 3.028 · 3.028 (est)
Related reactions
1 records
Compound notes
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