Cas no 2228375-32-2 (5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-thiol)

5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-thiol structure
2228375-32-2 structure
Product Name:5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-thiol
CAS No:2228375-32-2
MF:C5H4ClF3N2S
MW:216.611868858337
CID:5795195
PubChem ID:165671472
Update Time:2024-01-08

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

Names and Identifiers

    • 2228375-32-2
    • EN300-1960706
    • 5-chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-thiol
    • Inchi: 1S/C5H4ClF3N2S/c1-11-4(6)2(12)3(10-11)5(7,8)9/h12H,1H3
    • InChI Key: MYXVUYFYPHYEQS-UHFFFAOYSA-N
    • SMILES: ClC1=C(C(C(F)(F)F)=NN1C)S

Computed Properties

  • Exact Mass: 215.9735815g/mol
  • Monoisotopic Mass: 215.9735815g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 177
  • 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: 2.3
  • Topological Polar Surface Area: 18.8?2

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

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
EN300-1960706-0.05g
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Enamine
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