Cas no 161038-55-7 (3-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole)

3-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole structure
161038-55-7 structure
Product Name:3-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole
CAS No:161038-55-7
MF:C5H4ClF3N2
MW:184.546870231628
CID:105977
PubChem ID:10375144
Update Time:2025-04-18

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

Names and Identifiers

    • 1H-Pyrazole,3-chloro-1-methyl-5-(trifluoromethyl)-
    • 3-Chloro-1-methyl-5-trifluoromethyl-1H-pyrazole
    • 3-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole
    • EN300-102498
    • AT33513
    • 161038-55-7
    • AKOS023838766
    • YUCYYODSLSAZNB-UHFFFAOYSA-N
    • 3-chloro-1-methyl-5-(trifluoromethyl)pyrazole
    • CS-0230154
    • F8881-5069
    • SCHEMBL25320046
    • Inchi: 1S/C5H4ClF3N2/c1-11-3(5(7,8)9)2-4(6)10-11/h2H,1H3
    • InChI Key: YUCYYODSLSAZNB-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C(F)(F)F)N(C)N=1

Computed Properties

  • Exact Mass: 184.00162
  • Monoisotopic Mass: 184.0015103g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 149
  • 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: 17.8?2

Experimental Properties

  • PSA: 17.82

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

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