Cas no 82755-49-5 (1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole)

1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole structure
82755-49-5 structure
Product Name:1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole
CAS No:82755-49-5
MF:C6H7F3N2
MW:164.128391504288
MDL:MFCD09473459
CID:4204273
PubChem ID:15420923
Update Time:2025-04-24

1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole, 1,3-dimethyl-5-(trifluoromethyl)-
    • 1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole
    • 1,3-dimethyl-5-(trifluoromethyl)pyrazole
    • SCHEMBL3436871
    • STK351675
    • AKOS005167666
    • CS-0241085
    • MFCD09473459
    • 1,3-Dimethyl-5-trifluoromethyl-1H-pyrazole
    • EN300-231321
    • 82755-49-5
    • 1,3-dimethyl-5-trifluoromethylpyrazole
    • MDL: MFCD09473459
    • Inchi: 1S/C6H7F3N2/c1-4-3-5(6(7,8)9)11(2)10-4/h3H,1-2H3
    • InChI Key: ZXQWSYDWLBEQBS-UHFFFAOYSA-N
    • SMILES: FC(C1=CC(C)=NN1C)(F)F

Computed Properties

  • Exact Mass: 164.05613272g/mol
  • Monoisotopic Mass: 164.05613272g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 145
  • 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: 1.6
  • Topological Polar Surface Area: 17.8?2

1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole Pricemore >>

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1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole Production Method

Production Method 1

Reaction Conditions
1.1 Solvents: Dichloromethane ;  rt; 2 h, reflux
Reference
Synthesis of some trifluoromethyl substituted 1-methylpyrazoles
Pavlik, James W.; Ayudhya, Theppawut Israsena Na; Tantayanon, Supawan, Journal of Heterocyclic Chemistry, 2003, 40(6), 1087-1089

1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole Raw materials

1,3-dimethyl-5-(trifluoromethyl)-1H-pyrazole Preparation Products

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