2-bromo-N-cyclohexylacetamide

• ChemBase ID: 307804
• Molecular Formular: C8H14BrNO
• Molecular Mass: 220.10686
• Monoisotopic Mass: 219.02587607
• SMILES: C(=O)(NC1CCCCC1)CBr
• Canonical SMILES: BrCC(=O)NC1CCCCC1
• InChI: InChI=1S/C8H14BrNO/c9-6-8(11)10-7-4-2-1-3-5-7/h7H,1-6H2,(H,10,11)
• InChIKey: VQKRFCPNGGNHNN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-bromo-N-cyclohexylacetamide
• IUPAC Traditional name: 2-bromo-N-cyclohexylacetamide
• Synonyms: 2-bromo-N-cyclohexylacetamide

Database IDs

• CAS Number: 63177-66-2
• MDL Number: MFCD06149132

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 1.7154974
• LogD (pH = 7.4): 1.7154969
• Log P: 1.7154974
• Molar Refractivity: 48.1135 cm^3
• Polarizability: 18.726976 Å^3
• Polar Surface Area: 29.1 Å^2