Cas no 2098115-50-3 (1-(difluoromethyl)-4-ethenyl-1H-pyrazole)

1-(difluoromethyl)-4-ethenyl-1H-pyrazole structure
2098115-50-3 structure
Product Name:1-(difluoromethyl)-4-ethenyl-1H-pyrazole
CAS No:2098115-50-3
MF:C6H6F2N2
MW:144.122047901154
CID:5728942
PubChem ID:122241053
Update Time:2023-10-27

1-(difluoromethyl)-4-ethenyl-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 2098115-50-3
    • 1-(difluoromethyl)-4-ethenyl-1H-pyrazole
    • 1-(Difluoromethyl)-4-vinyl-1H-pyrazole
    • F2147-7902
    • 1-(difluoromethyl)-4-ethenylpyrazole
    • AKOS040814312
    • 1H-Pyrazole, 1-(difluoromethyl)-4-ethenyl-
    • Inchi: 1S/C6H6F2N2/c1-2-5-3-9-10(4-5)6(7)8/h2-4,6H,1H2
    • InChI Key: ALMSSCNCRQHCLV-UHFFFAOYSA-N
    • SMILES: FC(N1C=C(C=C)C=N1)F

Computed Properties

  • Exact Mass: 144.04990452g/mol
  • Monoisotopic Mass: 144.04990452g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 127
  • 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: 1.9
  • Topological Polar Surface Area: 17.8?2

Experimental Properties

  • Density: 1.19±0.1 g/cm3(Predicted)
  • Boiling Point: 162.7±40.0 °C(Predicted)
  • pka: -1.11±0.19(Predicted)

1-(difluoromethyl)-4-ethenyl-1H-pyrazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D137206-100mg
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$ 210.00 2022-06-05
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