Basic information
- Standard SMILES
CC(=O)c1ccc(C(C)(C)C(=O)O)cc1- InChIKey
ZRQIZAWBVNUPER-UHFFFAOYSA-N- Molecular formula
- C12H14O3
- Average molar mass
- 206.24 g/mol
Names & identifiers
- Preferred name
- 2-(4-Acetyl-phenyl)-2-methyl-propionic acid
- IUPAC
- 2-(4-acetylphenyl)-2-methylpropanoic acid
Names & synonyms
SCHEMBL6040838ZRQIZAWBVNUPER-UHFFFAOYSA-N2-(4-acetylphenyl)-2-methylpropanoic acid2-(4-acetyl-phenyl)-2-methyl-propionic acid857768-18-4
Database identifiers
- PubChem CID
- 21980962
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 260
Related reactions
1 records
Compound notes
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