Cas no 59321-55-0 (Pyridine, 2-(1,1-dimethylethyl)-6-phenyl-)

Pyridine, 2-(1,1-dimethylethyl)-6-phenyl- structure
59321-55-0 structure
Product Name:Pyridine, 2-(1,1-dimethylethyl)-6-phenyl-
CAS No:59321-55-0
MF:C15H17N
MW:211.302183866501
CID:339110
PubChem ID:4338916
Update Time:2025-04-19

Pyridine, 2-(1,1-dimethylethyl)-6-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Pyridine, 2-(1,1-dimethylethyl)-6-phenyl-
    • 2-tert-butyl-6-phenylpyridine
    • DTXSID30402078
    • 59321-55-0
    • 2-(tert-Butyl)-6-phenylpyridine
    • SCHEMBL7814795
    • Inchi: 1S/C15H17N/c1-15(2,3)14-11-7-10-13(16-14)12-8-5-4-6-9-12/h4-11H,1-3H3
    • InChI Key: RIMXAJBTBWXRFX-UHFFFAOYSA-N
    • SMILES: N1C(C2C=CC=CC=2)=CC=CC=1C(C)(C)C

Computed Properties

  • Exact Mass: 211.13621
  • Monoisotopic Mass: 211.136099547g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • 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: 4.9
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89
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