You are looking to Benzyl benzoate
General Information
Pubchem ID: 2345
IUPAC Name: benzyl benzoate
Synonym/s: Ascabiol, Benylate
Molecular Formula: C14H12O2
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 212.2400
Number of Atoms: 28
Rotatable Bonds: 4
Molecular Refractivity (m³ • mol-1 ): 62.190
Physico-chemical Properties
Volume (cm³ • mol-1 ): 790.78
Solvent Accessible Surface Area (Ų): 486.91
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 2
Total Charge: 0
pKa: None
AlogP: 3.26
Polar Surface Area (Å): 35.41
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Satisfied
Functional Group/s