You are looking to Ethyl Isobutyrate
General Information
Pubchem ID: 7342
IUPAC Name: ethyl 2-methylpropanoate
Synonym/s: Ethyl 2-methylpropanoate, Isobutyric acid ethyl ester
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 ): 31.360
Physico-chemical Properties
Volume (cm³ • mol-1 ): 548.81
Solvent Accessible Surface Area (Ų): 368.31
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 1
Total Charge: 0
pKa: None
AlogP: 1.49
Polar Surface Area (Å): 34.70
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Unsatisfied
Functional Group/s
Carbonyl
Ester