You are looking to Methylcinnamaldehyde
General Information
Pubchem ID: 7557
IUPAC Name: 2-methyl-3-phenylprop-2-enal
Synonym/s: ---, ---
Molecular Formula: C10H10O2S2
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 146.1900
Number of Atoms: 21
Rotatable Bonds: 2
Molecular Refractivity (m³ • mol-1 ): 46.490
Physico-chemical Properties
Volume (cm³ • mol-1 ): 596.95
Solvent Accessible Surface Area (Ų): 378.33
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 2.39
Polar Surface Area (Å): 36.41
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Satisfied
Ghose Filter: Unsatisfied
Functional Group/s
Carbonyl
Alkene
Aldehyde
Unsatured Carbonyl
Benzene Ring