Cas no 793619-69-9 (2-Bromo-6-methylquinoline-4-carbonitrile)

2-Bromo-6-methylquinoline-4-carbonitrile structure
793619-69-9 structure
Product Name:2-Bromo-6-methylquinoline-4-carbonitrile
CAS No:793619-69-9
MF:C11H7BrN2
MW:247.090681314468
CID:556186
PubChem ID:45123365
Update Time:2025-04-19

2-Bromo-6-methylquinoline-4-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Bromo-6-methylquinoline-4-carbonitrile
    • 4-Quinolinecarbonitrile, 2-bromo-6-methyl-
    • 793619-69-9
    • Inchi: 1S/C11H7BrN2/c1-7-2-3-10-9(4-7)8(6-13)5-11(12)14-10/h2-5H,1H3
    • InChI Key: UXYBZDRVVAYLMH-UHFFFAOYSA-N
    • SMILES: BrC1=CC(C#N)=C2C=C(C)C=CC2=N1

Computed Properties

  • Exact Mass: 245.97926g/mol
  • Monoisotopic Mass: 245.97926g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 257
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 36.7?2
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