Basic information
- CAS
28488-44-0- Standard SMILES
CCCc1ccc(O)c(C(=O)O)c1- InChIKey
QPFZHQMFWCRNPU-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- 2-Hydroxy-5-propylbenzoic acid
- IUPAC
- 2-hydroxy-5-propylbenzoic acid
Names & synonyms
2-Hydroxy-5-propylbenzoic acid28488-44-0Benzoic acid, 2-hydroxy-5-propyl-SCHEMBL2534915DTXSID70544643QPFZHQMFWCRNPU-UHFFFAOYSA-NAKOS011839882
Database identifiers
- CAS
28488-44-0- PubChem CID
- 13596103
- DTXSID
DTXSID70544643
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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