Cas no 1094754-90-1 (3-Bromo-6-fluoro-1H-indole)

3-Bromo-6-fluoro-1H-indole structure
3-Bromo-6-fluoro-1H-indole structure
Product Name:3-Bromo-6-fluoro-1H-indole
CAS No:1094754-90-1
MF:C8H5BrFN
MW:214.03440451622
MDL:MFCD11212293
CID:1011047
PubChem ID:43163571
Update Time:2025-04-20

3-Bromo-6-fluoro-1H-indole Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-6-fluoro-1H-indole
    • 3-Bromo-6-fluoroindole
    • EN300-1275484
    • DB-014634
    • 1094754-90-1
    • J-512071
    • AKOS009345669
    • DTXSID80655633
    • SCHEMBL16136433
    • MDL: MFCD11212293
    • Inchi: 1S/C8H5BrFN/c9-7-4-11-8-3-5(10)1-2-6(7)8/h1-4,11H
    • InChI Key: QFWZYCWYNOMSQC-UHFFFAOYSA-N
    • SMILES: BrC1=CNC2C=C(C=CC=21)F

Computed Properties

  • Exact Mass: 212.95900
  • Monoisotopic Mass: 212.95894g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 153
  • 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: 2.8
  • Topological Polar Surface Area: 15.8?2

Experimental Properties

  • Density: 1.750±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Very slightly soluble (0.15 g/l) (25 o C),
  • PSA: 15.79000
  • LogP: 3.06950

3-Bromo-6-fluoro-1H-indole Pricemore >>

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