Cas no 827042-59-1 (1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl-)

1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl- structure
827042-59-1 structure
Product Name:1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl-
CAS No:827042-59-1
MF:C9H7ClN2O2
MW:210.617080926895
CID:685867
PubChem ID:71417718
Update Time:2025-04-19

1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl-
    • 5-chloro-4-methyl-1H-benzimidazole-2-carboxylic acid
    • 5-Chloro-4-methyl-1H-benzo[d]imidazole-2-carboxylicacid
    • 5-Chloro-4-methyl-1H-benzo[d]imidazole-2-carboxylic acid
    • 827042-59-1
    • DTXSID80837053
    • Inchi: 1S/C9H7ClN2O2/c1-4-5(10)2-3-6-7(4)12-8(11-6)9(13)14/h2-3H,1H3,(H,11,12)(H,13,14)
    • InChI Key: BRZJFLRAFHKRKV-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2=C(C=1C)N=C(C(=O)O)N2

Computed Properties

  • Exact Mass: 210.0196052g/mol
  • Monoisotopic Mass: 210.0196052g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 249
  • 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: 2.3
  • Topological Polar Surface Area: 66?2

1H-Benzimidazole-2-carboxylic acid, 5-chloro-4-methyl- Pricemore >>

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