Cas no 134589-53-0 (3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid)

3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid structure
134589-53-0 structure
Product Name:3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid
CAS No:134589-53-0
MF:C5H4Cl2N2O2
MW:195.003458976746
MDL:MFCD20644726
CID:4591231
PubChem ID:11127155
Update Time:2024-03-01

3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid
    • MDL: MFCD20644726
    • Inchi: 1S/C5H4Cl2N2O2/c1-9-4(7)2(5(10)11)3(6)8-9/h1H3,(H,10,11)
    • InChI Key: MMDIWOSRSLNHLA-UHFFFAOYSA-N
    • SMILES: N1(C)C(Cl)=C(C(O)=O)C(Cl)=N1

Computed Properties

  • Exact Mass: 193.9649828g/mol
  • Monoisotopic Mass: 193.9649828g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 178
  • 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: 1.7
  • Topological Polar Surface Area: 55.1?2

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D475598-5mg
3,5-dichloro-1-methyl-1H-pyrazole-4-carboxylic acid
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$ 50.00 2022-06-05
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Enamine
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Enamine
EN300-307173-5g
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Enamine
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Enamine
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Enamine
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