Basic information
- Standard SMILES
CCC(CC)c1cccc(CO)c1- InChIKey
WXRPEEUTVFQSTE-UHFFFAOYSA-N- Molecular formula
- C12H18O
- Average molar mass
- 178.27 g/mol
Names & identifiers
- Preferred name
- 3-(3-Pentyl)benzyl alcohol
- IUPAC
- (3-pentan-3-ylphenyl)methanol
Names & synonyms
3-(3-pentyl)benzyl alcoholSCHEMBL7257287WXRPEEUTVFQSTE-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 54455151
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 129
Related reactions
4 records
Compound notes
Loading…