Cas no 5775-91-7 (4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid)

4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid structure
5775-91-7 structure
Product Name:4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid
CAS No:5775-91-7
MF:C6H7BrN2O2
MW:219.035980463028
MDL:MFCD02090877
CID:1074734
PubChem ID:2756953
Update Time:2025-09-19

4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid
    • 4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid
    • MFCD02090877
    • W15922
    • STK315902
    • A902633
    • F2169-0649
    • 5775-91-7
    • SY079849
    • 4-Bromo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid, AldrichCPR
    • ALBB-012533
    • 4-bromo-1,5-dimethylpyrazole-3-carboxylic acid
    • 4-Bromo-1,5-dimethyl-1H-pyrazole-3-carboxylicacid
    • EN300-83499
    • AKOS000304129
    • FS-1390
    • 1H-Pyrazole-3-carboxylic acid, 4-bromo-1,5-dimethyl-
    • SCHEMBL3140977
    • DB-128829
    • CS-0197728
    • AM100982
    • 4-bromo-1,5-dimethyl-1H-pyrazole-3-carboxylic acid(SALTDATA: FREE)
    • DTXSID70373652
    • 4-bromo-1,5-dimethyl-3-pyrazolecarboxylic acid
    • 4-bromo-3-carboxy-1,5-dimethylpyrazole
    • DTXCID70324684
    • MDL: MFCD02090877
    • Inchi: 1S/C6H7BrN2O2/c1-3-4(7)5(6(10)11)8-9(3)2/h1-2H3,(H,10,11)
    • InChI Key: HYGZWJRDMQFLCD-UHFFFAOYSA-N
    • SMILES: BrC1C(C(=O)O)=NN(C)C=1C

Computed Properties

  • Exact Mass: 217.96911
  • Monoisotopic Mass: 217.969
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 176
  • 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
  • Topological Polar Surface Area: 55.1A^2
  • XLogP3: 1.2

Experimental Properties

  • PSA: 55.12

4-bromo-1,5-dimethyl-pyrazole-3-carboxylic acid Pricemore >>

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