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Basic information
- Standard SMILES
Cc1ccccc1C(CCCO)C(=O)O- InChIKey
GJGHEAKSFHVJCX-UHFFFAOYSA-N- Molecular formula
- C12H16O3
- Average molar mass
- 208.25 g/mol
- Monoisotopic mass
- 208.10994437
Names & identifiers
- Preferred name
- 5-Hydroxy-2-(2-methylphenyl)pentanoic acid
- IUPAC
- 5-hydroxy-2-(2-methylphenyl)pentanoic acid
Names & synonyms
NSC620052CHEMBL1982990AKOS017995999NSC-620052NCI60_005930
Database identifiers
- PubChem CID
- 359302
- ChEMBL
CHEMBL1982990
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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