You are looking to 2-Phenylbutyric Acid
General Information
Pubchem ID: 7012
IUPAC Name: 2-phenylbutanoic acid
Synonym/s: Ethylphenylacetic acid, ---
Molecular Formula: C10H12O2
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 164.2000
Number of Atoms: 24
Rotatable Bonds: 3
Molecular Refractivity (m³ • mol-1 ): 46.540
Physico-chemical Properties
Volume (cm³ • mol-1 ): 627.47
Solvent Accessible Surface Area (Ų): 389.32
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 0
Total Charge: 0
pKa: 4.36
AlogP: 2.38
Polar Surface Area (Å): 48.44
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Satisfied
Functional Group/s
Carbonyl
Carboxylic acid
Arene
Benzene