You are looking to Hexyl Acetate
General Information
Pubchem ID: 8908
IUPAC Name: hexyl acetate
Synonym/s: Hexyl ethanoate, ---
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 ): 40.480
Physico-chemical Properties
Volume (cm³ • mol-1 ): 0.00
Solvent Accessible Surface Area (Ų): 0.00
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 2
Total Charge: 0
pKa: None
AlogP: 2.26
Polar Surface Area (Å): 26.30
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Unsatisfied
Functional Group/s
Carbonyl
Ester