Cas no 94278-29-2 (Pyridine,2-(5-methylhexyl)-)

Pyridine,2-(5-methylhexyl)- structure
Pyridine,2-(5-methylhexyl)- structure
Product Name:Pyridine,2-(5-methylhexyl)-
CAS No:94278-29-2
MF:C12H19N
MW:177.28596329689
CID:808929
PubChem ID:3024242
Update Time:2025-04-19

Pyridine,2-(5-methylhexyl)- Chemical and Physical Properties

Names and Identifiers

    • Pyridine,2-(5-methylhexyl)-
    • 2-(5-methylhexyl)pyridine
    • DTXSID90241389
    • SCHEMBL16181057
    • 94278-29-2
    • NS00066552
    • EINECS 304-718-8
    • Inchi: 1S/C12H19N/c1-11(2)7-3-4-8-12-9-5-6-10-13-12/h5-6,9-11H,3-4,7-8H2,1-2H3
    • InChI Key: WXZQNHOHMPCZGQ-UHFFFAOYSA-N
    • SMILES: N1C=CC=CC=1CCCCC(C)C

Computed Properties

  • Exact Mass: 177.152
  • Monoisotopic Mass: 177.152
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 120
  • 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: 3.7
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Density: 0.893
  • Boiling Point: 243.9°Cat760mmHg
  • Flash Point: 83°C
  • Refractive Index: 1.486
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