Basic information
- Standard SMILES
O=C(O)CCCCCCc1ccccc1CO- InChIKey
JRWTYPCUZFUHIJ-UHFFFAOYSA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.31 g/mol
Names & identifiers
- Preferred name
- 2-(6-Carboxyhexyl)benzyl alcohol
- IUPAC
- 7-[2-(hydroxymethyl)phenyl]heptanoic acid
Names & synonyms
SCHEMBL117191242-(6-carboxyhexyl)benzyl alcoholJRWTYPCUZFUHIJ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 53971444
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 216
Related reactions
1 records
Compound notes
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