Cas no 120842-55-9 (1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde)

1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde structure
120842-55-9 structure
Product Name:1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde
CAS No:120842-55-9
MF:C7H9ClN2O
MW:172.61216044426
MDL:MFCD02855986
CID:895798
PubChem ID:13764855
Update Time:2025-04-19

1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 1-(2-chloroethyl)-5-methyl-1H-Pyrazole-4-carboxaldehyde
    • LogP
    • 1-(2-CHLOROETHYL)-5-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
    • 1-(2-chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde(SALTDATA: FREE)
    • 1-(2-chloroethyl)-5-methylpyrazole-4-carbaldehyde
    • 1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde
    • MDL: MFCD02855986
    • Inchi: 1S/C7H9ClN2O/c1-6-7(5-11)4-9-10(6)3-2-8/h4-5H,2-3H2,1H3
    • InChI Key: QPXDCNHFMCCQOT-UHFFFAOYSA-N
    • SMILES: ClCCN1C(C)=C(C=O)C=N1

Computed Properties

  • Exact Mass: 172.04047
  • Monoisotopic Mass: 172.0403406g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 142
  • 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: 0.6
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • PSA: 34.89

1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde Pricemore >>

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abcr
AB214238-100g
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AB214238-1 g
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abcr
AB214238-5 g
1-(2-Chloroethyl)-5-methyl-1H-pyrazole-4-carbaldehyde; 95%
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abcr
AB214238-10 g
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