Cas no 1031417-75-0 (3,7-dimethyl-2H-indazole-5-carboxylic acid)

3,7-dimethyl-2H-indazole-5-carboxylic acid structure
1031417-75-0 structure
Product Name:3,7-dimethyl-2H-indazole-5-carboxylic acid
CAS No:1031417-75-0
MF:C10H10N2O2
MW:190.198602199554
MDL:MFCD18642423
CID:1091010
PubChem ID:55271466
Update Time:2025-04-20

3,7-dimethyl-2H-indazole-5-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3,7-Dimethyl-1H-indazole-5-carboxylic acid
    • 3,7-dimethyl-2H-indazole-5-carboxylic acid
    • AU-004/43508082
    • SCHEMBL1145053
    • BBL102052
    • DB-105231
    • 1031417-75-0
    • ZPWKLSSETKSKAL-UHFFFAOYSA-N
    • AKOS006320525
    • A904613
    • MFCD18642423
    • CS-0365853
    • 3,7-DIMETHYL-1H-INDAZOLE-5-CARBOXYLICACID
    • STL555851
    • DTXSID70717234
    • MDL： MFCD18642423
    • Inchi： 1S/C10H10N2O2/c1-5-3-7(10(13)14)4-8-6(2)11-12-9(5)8/h3-4H,1-2H3,(H,11,12)(H,13,14)
    • InChI Key： ZPWKLSSETKSKAL-UHFFFAOYSA-N
    • SMILES： OC(C1C=C(C)C2C(C=1)=C(C)NN=2)=O

Computed Properties

  • Exact Mass: 190.074227566g/mol
  • Monoisotopic Mass: 190.074227566g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 244
  • 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: 1.8
  • Topological Polar Surface Area: 66?2

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