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You are looking to Eugenol Acetate



General Information

Pubchem ID: 7136

IUPAC Name: (2-methoxy-4-prop-2-enylphenyl) acetate

Synonym/s: Acetyleugenol, ---

Molecular Formula: C12H14O3

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 206.2400

Number of Atoms: 29

Rotatable Bonds: 5

Molecular Refractivity (m³ • mol-1 ): 57.940



Physico-chemical Properties

Volume (cm³ • mol-1 ): 782.30

Solvent Accessible Surface Area (Ų): 482.87

Hydrogen Bond Donor: 0

Hydrogen Bond Acceptor: 3

Total Charge: 0

pKa: None

AlogP: 2.58

Polar Surface Area (Å): 44.90



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Unsatisfied

Ghose Filter: Satisfied



Functional Group/s

Carbonyl

Alkene

Ether

Ester

Benzene Ring