You are looking to Acetophenone
General Information
Pubchem ID: 7410
IUPAC Name: 1-Phenylethanone
Synonym/s: Methyl phenyl ketone, ---
Molecular Formula: C8H8O2
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 120.1500
Number of Atoms: 17
Rotatable Bonds: 1
Molecular Refractivity (m³ • mol-1 ): 36.460
Physico-chemical Properties
Volume (cm³ • mol-1 ): 501.05
Solvent Accessible Surface Area (Ų): 329.10
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 1.57
Polar Surface Area (Å): 28.76
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Satisfied
Ghose Filter: Unsatisfied
Functional Group/s
Carbonyl
Ketone
Arene
Benzene