Cas no 113100-61-1 (1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride)

1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride structure
113100-61-1 structure
Product Name:1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride
CAS No:113100-61-1
MF:C6H7ClN2O
MW:158.58558011055
MDL:MFCD03421497
CID:130045
PubChem ID:3159698
Update Time:2025-04-19

1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-4-carbonylchloride, 1,3-dimethyl-
    • 1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride
    • 1,3-dimethylpyrazole-4-carboxylic acid chloride
    • AC1MKML4
    • ACMC-20dsgw
    • ALBB-009196
    • CTK0H2923
    • 1,3-dimethylpyrazole-4-carbonyl chloride
    • 1,3-dimethyl-4-pyrazolecarbonyl chloride
    • 1H-Pyrazole-4-carbonyl chloride, 1,3-dimethyl- (9CI)
    • VS-14449
    • SCHEMBL976056
    • MFCD03421497
    • FT-0677728
    • DTXSID30390244
    • 1,3-Dimethyl-1H-pyrazole-4-carbonylchloride
    • BB 0253237
    • 1,3-dimethyl-1H-pyrazole-4-carboxylic acid chloride
    • 113100-61-1
    • LQXIVMYOLYCNMZ-UHFFFAOYSA-N
    • AKOS005171976
    • MDL： MFCD03421497
    • Inchi： 1S/C6H7ClN2O/c1-4-5(6(7)10)3-9(2)8-4/h3H,1-2H3
    • InChI Key： LQXIVMYOLYCNMZ-UHFFFAOYSA-N
    • SMILES： ClC(C1=CN(C)N=C1C)=O

Computed Properties

  • Exact Mass: 158.02481
  • Monoisotopic Mass: 158.025
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 151
  • 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: 1.1
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • PSA: 34.89

1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride Security Information

  • HazardClass：IRRITANT

1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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AB250787-500 mg
1,3-Dimethyl-1H-pyrazole-4-carbonyl chloride; .
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AB250787-1 g
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AB250787-5 g
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AB250787-500mg
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 €397.00 2025-03-19
abcr
AB250787-1g
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 €477.00 2025-03-19
abcr
AB250787-5g
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 €1277.00 2025-03-19
Chemenu
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