Cas no 2098105-49-6 (1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile)

1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile structure
2098105-49-6 structure
Product Name:1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
CAS No:2098105-49-6
MF:C11H7F2N3
MW:219.190188646317
CID:5728766
PubChem ID:121211341
Update Time:2023-10-27

1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • AKOS026721455
    • 2-(difluoromethyl)-5-phenylpyrazole-3-carbonitrile
    • 2098105-49-6
    • 1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
    • F2198-1328
    • 1H-Pyrazole-5-carbonitrile, 1-(difluoromethyl)-3-phenyl-
    • Inchi： 1S/C11H7F2N3/c12-11(13)16-9(7-14)6-10(15-16)8-4-2-1-3-5-8/h1-6,11H
    • InChI Key： GBIAAYWSYYCMST-UHFFFAOYSA-N
    • SMILES： FC(N1C(C#N)=CC(C2C=CC=CC=2)=N1)F

Computed Properties

  • Exact Mass: 219.06080356g/mol
  • Monoisotopic Mass: 219.06080356g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 280
  • 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: 2.8
  • Topological Polar Surface Area: 41.6?2

Experimental Properties

  • Density: 1.28±0.1 g/cm3(Predicted)
  • Boiling Point: 330.5±42.0 °C(Predicted)
  • pka: -5.74±0.19(Predicted)

1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D137176-100mg
1-(difluoromethyl)-3-phenyl-1h-pyrazole-5-carbonitrile
 2098105-49-6
100mg
 $ 135.00 2022-06-05
TRC
D137176-500mg
1-(difluoromethyl)-3-phenyl-1h-pyrazole-5-carbonitrile
 2098105-49-6
500mg
 $ 500.00 2022-06-05
TRC
D137176-1g
1-(difluoromethyl)-3-phenyl-1h-pyrazole-5-carbonitrile
 2098105-49-6
1g
 $ 775.00 2022-06-05
Life Chemicals
F2198-1328-0.25g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
0.25g
 $479.0 2023-09-06
Life Chemicals
F2198-1328-0.5g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
0.5g
 $505.0 2023-09-06
Life Chemicals
F2198-1328-1g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
1g
 $532.0 2023-09-06
Life Chemicals
F2198-1328-2.5g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
2.5g
 $1064.0 2023-09-06
Life Chemicals
F2198-1328-5g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
5g
 $1596.0 2023-09-06
Life Chemicals
F2198-1328-10g
1-(difluoromethyl)-3-phenyl-1H-pyrazole-5-carbonitrile
 2098105-49-6 95%+
10g
 $2234.0 2023-09-06

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