Cas no 5191-54-8 (Pyridine,4-methyl-2-(phenylmethyl)-)

Pyridine,4-methyl-2-(phenylmethyl)- structure
5191-54-8 structure
Product Name:Pyridine,4-methyl-2-(phenylmethyl)-
CAS No:5191-54-8
MF:C13H13N
MW:183.249023199081
CID:383745
PubChem ID:78865
Update Time:2025-04-19

Pyridine,4-methyl-2-(phenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • Pyridine,4-methyl-2-(phenylmethyl)-
    • 2-Benzyl-4-methylpyridine
    • Q63392142
    • NS00032373
    • DTXSID30199875
    • Pyridine, 4-methyl-2-(phenylmethyl)-
    • UNII-V6C6SNG7AV
    • SCHEMBL13562418
    • 5191-54-8
    • V6C6SNG7AV
    • 4-METHYL-2-(PHENYLMETHYL)PYRIDINE
    • EINECS 225-975-1
    • Inchi: 1S/C13H13N/c1-11-7-8-14-13(9-11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
    • InChI Key: BMVGPICTSDRAIS-UHFFFAOYSA-N
    • SMILES: N1C=CC(C)=CC=1CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 183.10489
  • Monoisotopic Mass: 183.104799419g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 161
  • 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: 12.9?2

Experimental Properties

  • PSA: 12.89
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