Cas no 159307-02-5 (6-acetylpyridine-2-carbonitrile)

6-acetylpyridine-2-carbonitrile structure
159307-02-5 structure
Product Name:6-acetylpyridine-2-carbonitrile
CAS No:159307-02-5
MF:C8H6N2O
MW:146.14604139328
MDL:MFCD09263905
CID:109169
PubChem ID:15218805
Update Time:2025-04-18

6-acetylpyridine-2-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 6-acetyl-2-Pyridinecarbonitrile
    • 2-Pyridinecarbonitrile,6-acetyl-
    • 6-acetylpyridine-2-carbonitrile
    • 2-acetyl-6-cyanopyridine
    • 2-cyano-6-acetylpyridine
    • 2-PYRIDINECARBONITRILE,6-ACETYL
    • 6-Acetyl-2-cyanopyridine
    • 6-ACETYLPICOLINONITRILE
    • 2-Pyridinecarbonitrile, 6-acetyl- (9CI)
    • LECIQDJPKUDAHR-UHFFFAOYSA-N
    • AB50229
    • AK439105
    • SCHEMBL7770340
    • MFCD09263905
    • 2-PYRIDINECARBONITRILE, 6-ACETYL-
    • DS-18801
    • AKOS006332390
    • C73010
    • 159307-02-5
    • CS-0147272
    • FT-0749816
    • A928522
    • DTXSID70570184
    • DB-083131
    • MDL： MFCD09263905
    • Inchi： 1S/C8H6N2O/c1-6(11)8-4-2-3-7(5-9)10-8/h2-4H,1H3
    • InChI Key： LECIQDJPKUDAHR-UHFFFAOYSA-N
    • SMILES： O=C(C)C1C=CC=C(C#N)N=1

Computed Properties

  • Exact Mass: 146.04800
  • Monoisotopic Mass: 146.048012819g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 203
  • 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
  • Topological Polar Surface Area: 53.8
  • XLogP3: 0.9

Experimental Properties

  • PSA: 53.75000
  • LogP: 1.15588

6-acetylpyridine-2-carbonitrile Pricemore >>

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