Cas no 58644-56-7 (Pyridine, 4-(isocyanomethyl)-)

Pyridine, 4-(isocyanomethyl)- structure
Pyridine, 4-(isocyanomethyl)- structure
Product Name:Pyridine, 4-(isocyanomethyl)-
CAS No:58644-56-7
MF:C7H6N2
MW:118.135941028595
MDL:MFCD02664554
CID:341367
PubChem ID:2771560
Update Time:2025-10-28

Pyridine, 4-(isocyanomethyl)- Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 4-(isocyanomethyl)-
    • 4-(ISOCYANOMETHYL)PYRIDINE
    • 4-isocyanomethylpyridin
    • 4-isocyanomethyl-pyridine
    • 4-pyridylmethyl isocyanide
    • TOS-BB-0794
    • GS-0289
    • AC8779
    • MFCD02664554
    • SY263029
    • 4-Isocyanomethylpyridine
    • AKOS001476718
    • SCHEMBL6968162
    • DTXSID40377960
    • EN300-702554
    • 58644-56-7
    • 4-(Isocyanomethyl)pyridine, AldrichCPR
    • DB-315886
    • MDL: MFCD02664554
    • Inchi: 1S/C7H6N2/c1-8-6-7-2-4-9-5-3-7/h2-5H,6H2
    • InChI Key: MCYOVNZPMYQFTF-UHFFFAOYSA-N
    • SMILES: N1C=CC(=CC=1)C[N+]#[C-]

Computed Properties

  • Exact Mass: 118.05300
  • Monoisotopic Mass: 118.053098200g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 116
  • 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: 0.6
  • Topological Polar Surface Area: 17.2?2

Experimental Properties

  • PSA: 12.89000
  • LogP: 0.73160

Pyridine, 4-(isocyanomethyl)- Pricemore >>

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