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You are looking to ETHYL HEPTANOATE



General Information

Pubchem ID: 7797

IUPAC Name: ethyl heptanoate

Synonym/s: Ethyl enanthate, Wine oil

Molecular Formula: C9H18O2

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 158.2400

Number of Atoms: 29

Rotatable Bonds: 7

Molecular Refractivity (m³ • mol-1 ): 45.190



Physico-chemical Properties

Volume (cm³ • mol-1 ): 733.88

Solvent Accessible Surface Area (Ų): 468.42

Hydrogen Bond Donor: 0

Hydrogen Bond Acceptor: 2

Total Charge: 0

pKa: None

AlogP: 2.86

Polar Surface Area (Å): 36.62



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Unsatisfied

Ghose Filter: Unsatisfied



Functional Group/s

Carbonyl

Ester