Cas no 1044771-97-2 (methyl 7-bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate)

methyl 7-bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate structure
1044771-97-2 structure
Product Name:methyl 7-bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate
CAS No:1044771-97-2
MF:C8H6BrN3O2
MW:256.056140422821
CID:6835961
PubChem ID:24903738
Update Time:2025-04-03

methyl 7-bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • SY352092
    • Methyl 7-Bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate
    • 1044771-97-2
    • methyl 7-bromo-1H-imidazo[4,5-c]pyridine-2-carboxylate
    • Inchi: 1S/C8H6BrN3O2/c1-14-8(13)7-11-5-3-10-2-4(9)6(5)12-7/h2-3H,1H3,(H,11,12)
    • InChI Key: MLJULEJKYGCOFE-UHFFFAOYSA-N
    • SMILES: BrC1=CN=CC2=C1N=C(C(=O)OC)N2

Computed Properties

  • Exact Mass: 254.96434Da
  • Monoisotopic Mass: 254.96434Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 239
  • 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: 1.3
  • Topological Polar Surface Area: 67.9?2
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