Basic information
- Standard SMILES
CCC(C(=O)O)C(C)(C)c1ccccc1- InChIKey
XGOJBAHDYOBRBM-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
Names & identifiers
- Preferred name
- 2-Ethyl-3-methyl-3-phenylbutanoic acid
- IUPAC
- 2-ethyl-3-methyl-3-phenylbutanoic acid
Names & synonyms
2-ethyl-3-methyl-3-phenylbutanoic acid765932-20-5SCHEMBL4377967XGOJBAHDYOBRBM-UHFFFAOYSA-NEN300-1863140
Database identifiers
- PubChem CID
- 11275764
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 215
Related reactions
4 records
Compound notes
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