Cas no 175204-86-1 (4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile)

4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile structure
175204-86-1 structure
Product Name:4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile
CAS No:175204-86-1
MF:C5H4ClN3
MW:141.558359146118
MDL:MFCD00103546
CID:133949
PubChem ID:2782163
Update Time:2025-04-19

4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile
    • 1H-Pyrazole-3-carbonitrile,4-chloro-1-methyl-
    • 4-chloro-1-methylpyrazole-3-carbonitrile
    • AC1MD1PB
    • AG-E-25390
    • CTK4D5642
    • MolPort-001-765-782
    • SBB073756
    • 4-Chloro-3-cyano-1-methyl-1H-pyrazole
    • 1H-Pyrazole-3-carbonitrile,4-chloro-1-methyl-(9CI)
    • MFCD00103546
    • AKOS005199227
    • AT34338
    • 175204-86-1
    • FT-0617981
    • DTXSID30381955
    • 1H-Pyrazole-3-carbonitrile, 4-chloro-1-methyl-
    • EN300-232645
    • CS-0241375
    • MDL: MFCD00103546
    • Inchi: 1S/C5H4ClN3/c1-9-3-4(6)5(2-7)8-9/h3H,1H3
    • InChI Key: VCGBVTFJVGRBCJ-UHFFFAOYSA-N
    • SMILES: ClC1C(C#N)=NN(C)C=1

Computed Properties

  • Exact Mass: 141.00952
  • Monoisotopic Mass: 141.0093748g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 150
  • 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: 0.9
  • Topological Polar Surface Area: 41.6?2

Experimental Properties

  • Density: 1.34
  • Melting Point: 91-93°C
  • Boiling Point: 281.3°C at 760 mmHg
  • Flash Point: 123.9°C
  • Refractive Index: 1.609
  • PSA: 41.61

4-Chloro-1-methyl-1H-pyrazole-3-carbonitrile Pricemore >>

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abcr
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€231.60 2022-03-05
abcr
AB130763-250 mg
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AB130763-500 mg
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€409.30 2022-03-05
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AB130763-1 g
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€486.60 2022-03-05
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AB130763-5 g
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Enamine
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