You are looking to Vanillic acid
General Information
Pubchem ID: 8468
IUPAC Name: 4-hydroxy-3-methoxybenzoic acid
Synonym/s: Vanillate, 3-methyl ester protocatechuic acid
Molecular Formula: C8H8O4
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 168.1500
Number of Atoms: 20
Rotatable Bonds: 2
Molecular Refractivity (m³ • mol-1 ): 40.970
Physico-chemical Properties
Volume (cm³ • mol-1 ): 0.00
Solvent Accessible Surface Area (Ų): 0.00
Hydrogen Bond Donor: 1
Hydrogen Bond Acceptor: 2
Total Charge: 0
pKa: None
AlogP: 1.15
Polar Surface Area (Å): 66.76
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Satisfied
Ghose Filter: Satisfied
Functional Group/s
Carbonyl
Alkene
Aldehyde
Ether
Phenol