Cas no 90731-96-7 (3-bromo-4-(propan-2-yl)pyridine)

3-bromo-4-(propan-2-yl)pyridine structure
90731-96-7 structure
Product Name:3-bromo-4-(propan-2-yl)pyridine
CAS No:90731-96-7
MF:C8H10BrN
MW:200.075701236725
MDL:MFCD01646219
CID:797058
PubChem ID:13160534
Update Time:2025-04-19

3-bromo-4-(propan-2-yl)pyridine Chemical and Physical Properties

Names and Identifiers

    • Pyridine,3-bromo-4-(1-methylethyl)-
    • 3-bromo-4-propan-2-ylpyridine
    • 3-bromo-4-i-propylpyridine
    • 3-BROMO-4-ISOPROPYLPYRIDINE
    • Pyridine,3-bromo-4-(1-methylethyl)
    • 3-bromo-4-(propan-2-yl)pyridine
    • DTXSID70523433
    • 90731-96-7
    • AT12875
    • CS-0242011
    • SCHEMBL3810939
    • A19293
    • Pyridine, 3-bromo-4-(1-methylethyl)-
    • GS2506
    • EN300-243266
    • SY346812
    • AC-907/34120007
    • MFCD01646219
    • MDL： MFCD01646219
    • Inchi： 1S/C8H10BrN/c1-6(2)7-3-4-10-5-8(7)9/h3-6H,1-2H3
    • InChI Key： WSNTVJABNWFYPA-UHFFFAOYSA-N
    • SMILES： BrC1C=NC=CC=1C(C)C

Computed Properties

  • Exact Mass: 199.00000
  • Monoisotopic Mass: 198.99966g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 103
  • 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: 2.7
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Density: 1.343±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 229.4±20.0 oC (760 Torr),
  • Flash Point: 92.5±21.8 oC,
  • Solubility: Slightly soluble (1.5 g/l) (25 o C),
  • PSA: 12.89000
  • LogP: 2.96750

3-bromo-4-(propan-2-yl)pyridine Pricemore >>

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