Cas no 27876-19-3 (4-(1-methylpropyl)-Pyridine)

4-(1-methylpropyl)-Pyridine structure
4-(1-methylpropyl)-Pyridine structure
Product Name:4-(1-methylpropyl)-Pyridine
CAS No:27876-19-3
MF:C9H13N
MW:135.206222295761
CID:1110239
PubChem ID:15556938
Update Time:2025-04-20

4-(1-methylpropyl)-Pyridine Chemical and Physical Properties

Names and Identifiers

    • 4-(1-methylpropyl)-Pyridine
    • 4-sec-Butylpyridine
    • LogP
    • pyridine, 4-(1-methylpropyl)-
    • SCHEMBL117057
    • DTXSID601031101
    • 4-butan-2-ylpyridine
    • Pyridine, 4-(1-methylpropyl)
    • AMY6162
    • 4-sec.-butylpyridin
    • 27876-19-3
    • CS-0069573
    • 4-sec-butyl-pyridine
    • 4-(sec-Butyl)pyridine
    • Inchi: 1S/C9H13N/c1-3-8(2)9-4-6-10-7-5-9/h4-8H,3H2,1-2H3
    • InChI Key: HGMLMFWWXQNLLV-UHFFFAOYSA-N
    • SMILES: N1C=CC(=CC=1)C(C)CC

Computed Properties

  • Exact Mass: 135.10489
  • Monoisotopic Mass: 135.104799419g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 84.7
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.5
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Density: 0.906
  • Boiling Point: 198.4°C at 760 mmHg
  • Flash Point: 67°C
  • Refractive Index: 1.49
  • PSA: 12.89
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