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You are looking to Methyl heptanoate



General Information

Pubchem ID: 7826

IUPAC Name: methyl heptanoate

Synonym/s: Methyl enanthate, ---

Molecular Formula: C8H16O2

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 144.2100

Number of Atoms: 26

Rotatable Bonds: 6

Molecular Refractivity (m³ • mol-1 ): 40.440



Physico-chemical Properties

Volume (cm³ • mol-1 ): 666.72

Solvent Accessible Surface Area (Ų): 429.49

Hydrogen Bond Donor: 0

Hydrogen Bond Acceptor: 2

Total Charge: 0

pKa: None

AlogP: 2.51

Polar Surface Area (Å): 37.45



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Unsatisfied

Ghose Filter: Unsatisfied



Functional Group/s

Carbonyl

Ester