Cas no 808764-27-4 (1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole)

1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole structure
808764-27-4 structure
Product Name:1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole
CAS No:808764-27-4
MF:C7H6ClF3N2O
MW:226.583550930023
CID:1004729
PubChem ID:2735842
Update Time:2025-04-20

1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole
    • 1-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone
    • 1-acetyl-4-chloro-3(5)-trifluoromethyl-5(3)-(methyl)pyrazole
    • 1-Acetyl-4-chloro-5(3)-methyl-3(5)-trifluoromethyl pyrazole
    • DTXSID10370983
    • 1-(4-Chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)ethan-1-one
    • MFCD00153623
    • AKOS007930768
    • 808764-27-4
    • 1-(4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)ethanone
    • 1-acetyl-4-chloro-5-methyl-3-(trifluoromethyl)-1h-pyrazole
    • 1-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
    • DB-201512
    • NERAROFZQWLXHC-UHFFFAOYSA-N
    • 231301-10-3
    • MDL: MFCD00153623
    • Inchi: 1S/C7H6ClF3N2O/c1-3-5(8)6(7(9,10)11)12-13(3)4(2)14/h1-2H3
    • InChI Key: NERAROFZQWLXHC-UHFFFAOYSA-N
    • SMILES: ClC1C(C(F)(F)F)=NN(C(C)=O)C=1C

Computed Properties

  • Exact Mass: 226.0120750g/mol
  • Monoisotopic Mass: 226.0120750g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 246
  • 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: 2.1
  • Topological Polar Surface Area: 34.9?2

1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole Security Information

1-Acetyl-4-chloro-5(3)-methyl-3(5)-(trifluoromethyl)pyrazole Pricemore >>

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