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You are looking to 2-Methylvaleric Acid



General Information

Pubchem ID: 7341

IUPAC Name: 2-methylpentanoic acid

Synonym/s: Methylpropylacetic acid, ---

Molecular Formula: C6H12O2

SMILES:


Known Interaction/s




Structural Values

Molecular Weight (Da): 116.1600

Number of Atoms: 20

Rotatable Bonds: 3

Molecular Refractivity (m³ • mol-1 ): 31.040



Physico-chemical Properties

Volume (cm³ • mol-1 ): 512.52

Solvent Accessible Surface Area (Ų): 335.43

Hydrogen Bond Donor: 0

Hydrogen Bond Acceptor: 0

Total Charge: 0

pKa: 4.65

AlogP: 1.81

Polar Surface Area (Å): 47.58



Pharmacological Analysis

Rule of Five or Lipinsky Rule: Satisfied

Rule of Three: Unsatisfied

Ghose Filter: Unsatisfied



Functional Group/s

Carbonyl

Carboxylic acid