Cas no 683242-75-3 (2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester)

2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester structure
683242-75-3 structure
Product Name:2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester
CAS No:683242-75-3
MF:C9H7ClN2O2
MW:210.617080926895
CID:2121956
PubChem ID:11543028
Update Time:2024-10-28

2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester
    • Methyl 2-chloro-1H-benzimidazole-5-carboxylate
    • SCHEMBL1097139
    • SY310445
    • methyl 2-chloro-3H-benzimidazole-5-carboxylate
    • Methyl2-chloro-1H-benzo[d]imidazole-5-carboxylate
    • EN300-719390
    • Methyl 2-chloro-1H-benzo[d]imidazole-5-carboxylate
    • methyl 2-chloro-1H-benzo[d]imidazole-6-carboxylate
    • 1H-Benzimidazole-5-carboxylic acid, 2-chloro-, methyl ester
    • G72718
    • methyl 2-chloro-1H-1,3-benzodiazole-6-carboxylate
    • methyl 2-chloro-3H-benzo[d]imidazole-5-carboxylate
    • methyl 2-chloro-1H-benzimidazole-6-carboxylate
    • Methyl 2-Chlorobenzimidazole-5-carboxylate
    • USTUYGJVCPXGJG-UHFFFAOYSA-N
    • DB-302927
    • 683242-75-3
    • MFCD22561321
    • Inchi: InChI=1S/C9H7ClN2O2/c1-14-8(13)5-2-3-6-7(4-5)12-9(10)11-6/h2-4H,1H3,(H,11,12)
    • InChI Key: USTUYGJVCPXGJG-UHFFFAOYSA-N
    • SMILES: COC(=O)C1=CC2=C(C=C1)N=C(N2)Cl

Computed Properties

  • Exact Mass: 210.0196052g/mol
  • Monoisotopic Mass: 210.0196052g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 237
  • 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: 55?2

2-chloro-1H-benzoimidazole-5-carboxylic acid methyl ester Pricemore >>

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