Cas no 1198103-42-2 (6-(Difluoromethoxy)nicotinonitrile)

6-(Difluoromethoxy)nicotinonitrile structure
1198103-42-2 structure
Product Name:6-(Difluoromethoxy)nicotinonitrile
CAS No:1198103-42-2
MF:C7H4F2N2O
MW:170.116268157959
CID:1031363
PubChem ID:46311555
Update Time:2024-11-03

6-(Difluoromethoxy)nicotinonitrile Chemical and Physical Properties

Names and Identifiers

    • 6-(Difluoromethoxy)nicotinonitrile
    • 6-(difluoromethoxy)pyridine-3-carbonitrile
    • EN300-6489128
    • DTXSID70673301
    • 6-Difluoromethoxy-nicotinonitrile
    • Z1255366789
    • J-518062
    • SB85736
    • CS-0216934
    • 1198103-42-2
    • RASGKOKUJVRDAN-UHFFFAOYSA-N
    • 3-Pyridinecarbonitrile, 6-(difluoromethoxy)-
    • SCHEMBL4321088
    • AT12036
    • DB-333256
    • MDL: MFCD14698409
    • Inchi: 1S/C7H4F2N2O/c8-7(9)12-6-2-1-5(3-10)4-11-6/h1-2,4,7H
    • InChI Key: RASGKOKUJVRDAN-UHFFFAOYSA-N
    • SMILES: FC(OC1C=CC(C#N)=CN=1)F

Computed Properties

  • Exact Mass: 170.02916908g/mol
  • Monoisotopic Mass: 170.02916908g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 189
  • 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: 1.8
  • Topological Polar Surface Area: 45.9?2

6-(Difluoromethoxy)nicotinonitrile Pricemore >>

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