Cas no 56704-30-4 (3-Pyridinecarbonitrile, 2,6-dichloro-4,5-dimethyl-)

3-Pyridinecarbonitrile, 2,6-dichloro-4,5-dimethyl- structure
56704-30-4 structure
Product Name:3-Pyridinecarbonitrile, 2,6-dichloro-4,5-dimethyl-
CAS No:56704-30-4
MF:C8H6Cl2N2
MW:201.052639484406
CID:348075
PubChem ID:13849135
Update Time:2025-04-19

3-Pyridinecarbonitrile, 2,6-dichloro-4,5-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarbonitrile, 2,6-dichloro-4,5-dimethyl-
    • 2,6-dichloro-4,5-dimethylnicotinonitrile
    • 2,6-dichloro-4,5-dimethylpyridine-3-carbonitrile
    • SCHEMBL11822208
    • 56704-30-4
    • DTXSID90551192
    • AMY6078
    • CS-0069531
    • Inchi: 1S/C8H6Cl2N2/c1-4-5(2)7(9)12-8(10)6(4)3-11/h1-2H3
    • InChI Key: RKAFKNVKTHACRN-UHFFFAOYSA-N
    • SMILES: ClC1C(C)=C(C)C(C#N)=C(N=1)Cl

Computed Properties

  • Exact Mass: 199.99098
  • Monoisotopic Mass: 199.9908036g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 210
  • 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: 3.2
  • Topological Polar Surface Area: 36.7?2

Experimental Properties

  • PSA: 36.68

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