2-bromo-N-cyclopropylpropanamide

• ChemBase ID: 308208
• Molecular Formular: C6H10BrNO
• Molecular Mass: 192.0537
• Monoisotopic Mass: 190.99457595
• SMILES: C(=O)(NC1CC1)C(Br)C
• Canonical SMILES: CC(C(=O)NC1CC1)Br
• InChI: InChI=1S/C6H10BrNO/c1-4(7)6(9)8-5-2-3-5/h4-5H,2-3H2,1H3,(H,8,9)
• InChIKey: SJQGWHWWUNXACX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• MDL Number: MFCD10686587

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 0.95055556
• LogD (pH = 7.4): 0.95055455
• Log P: 0.95055556
• Molar Refractivity: 38.8044 cm^3
• Polarizability: 15.130096 Å^3
• Polar Surface Area: 29.1 Å^2