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RepOdor

You are looking to gamma-Octalactone



General Information

Pubchem ID: 7704

IUPAC Name: 5-butyloxolan-2-one

Synonym/s: 4-Octanolide, ---

Molecular Formula: C8H14O2

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 142.2000

Number of Atoms: 24

Rotatable Bonds: 3

Molecular Refractivity (m³ • mol-1 ): 38.450



Physico-chemical Properties

Volume (cm³ • mol-1 ): 606.27

Solvent Accessible Surface Area (Ų): 392.15

Hydrogen Bond Donor: 0

Hydrogen Bond Acceptor: 2

Total Charge: 0

pKa: None

AlogP: 2.09

Polar Surface Area (Å): 41.04



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Unsatisfied

Ghose Filter: Unsatisfied



Functional Group/s

Carbonyl

Ester

Lactone