You are looking to 2-Bromooctanoic acid
General Information
Pubchem ID: 552003
IUPAC Name: 2-bromooctanoic acid
Synonym/s: 2-Bromo-n-octanoic Acid, ---
Molecular Formula: C8H15BrO2
SMILES:
Known Interaction/s
Structural Values
Molecular Weight (Da): 223.1100
Number of Atoms: 26
Rotatable Bonds: 6
Molecular Refractivity (m³ • mol-1 ): 47.800
Physico-chemical Properties
Volume (cm³ • mol-1 ): 691.18
Solvent Accessible Surface Area (Ų): 434.56
Hydrogen Bond Donor: 0
Hydrogen Bond Acceptor: 0
Total Charge: 0
pKa: 2.98
AlogP: 3.28
Polar Surface Area (Å): 48.79
Pharmacological Analysis
Rule of Five or Lipinsky Rule: Satisfied
Rule of Three: Unsatisfied
Ghose Filter: Satisfied
Functional Group/s
Carbonyl
Carboxylic acid
Alkyl bromide
Alkyl halide
C(sp3)-leaving group