Basic information
- CAS
17479-65-1- Standard SMILES
Cc1cc(C(C)C)cc(O)c1C(=O)O- InChIKey
FJWIVROUSRYZLZ-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.0942943
Names & identifiers
- Preferred name
- m-CYMENE-6-CARBOXYLIC ACID, 5-HYDROXY-
- IUPAC
- 2-hydroxy-6-methyl-4-propan-2-ylbenzoic acid
Names & synonyms
m-CYMENE-6-CARBOXYLIC ACID, 5-HYDROXY-17479-65-1BRN 28353255-Hydroxy-m-cymene-6-carboxylic acid2-Hydroxy-4-isopropyl-6-methylbenzoic acidDTXSID501698982-hydroxy-6-methyl-4-(propan-2-yl)benzoic acid
Database identifiers
- CAS
17479-65-1- PubChem CID
- 28568
- DTXSID
DTXSID50169898
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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