Cas no 176722-63-7 (8-Bromo-2-(trifluoromethyl)quinoline)

8-Bromo-2-(trifluoromethyl)quinoline structure
176722-63-7 structure
Product Name:8-Bromo-2-(trifluoromethyl)quinoline
CAS No:176722-63-7
MF:C10H5BrF3N
MW:276.052612066269
MDL:MFCD08741357
CID:1031891
PubChem ID:15325794
Update Time:2024-11-01

8-Bromo-2-(trifluoromethyl)quinoline Chemical and Physical Properties

Names and Identifiers

    • 8-Bromo-2-(trifluoromethyl)quinoline
    • QUINOLINE, 8-BROMO-2-(TRIFLUOROMETHYL)-
    • AB48759
    • AG-A-92668
    • AGN-PC-00OW2Q
    • CTK5I8647
    • PC9226
    • 8-broMo-2-(trifluoroMethyl)-
    • 8-broMo-2-(trifluoroMethyl)quinoline,Quinoline
    • MFCD08741357
    • CS-0060623
    • BHA72263
    • AS-64134
    • AKOS015897045
    • FT-0765408
    • A25658
    • DTXSID60571524
    • 8-BROMO-2-(TRIFLUOROMETHYL)-QUINOLINE
    • 176722-63-7
    • DB-065162
    • MDL: MFCD08741357
    • Inchi: 1S/C10H5BrF3N/c11-7-3-1-2-6-4-5-8(10(12,13)14)15-9(6)7/h1-5H
    • InChI Key: OSWXDIFARUFKTR-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC2=CC=C(C(F)(F)F)N=C21

Computed Properties

  • Exact Mass: 274.95575
  • Monoisotopic Mass: 274.95575g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 231
  • 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: 3.9
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Density: 1.658±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 62-63 oC (pentane pentane )
  • Boiling Point: 284.3±35.0 oC (760 Torr),
  • Flash Point: 125.7±25.9 oC,
  • Solubility: Very slightly soluble (0.14 g/l) (25 o C),
  • PSA: 12.89

8-Bromo-2-(trifluoromethyl)quinoline Pricemore >>

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