Cas no 1242260-51-0 (Ethyl 4,6-dibromoquinoline-3-carboxylate)

Ethyl 4,6-dibromoquinoline-3-carboxylate structure
1242260-51-0 structure
Product Name:Ethyl 4,6-dibromoquinoline-3-carboxylate
CAS No:1242260-51-0
MF:C12H9Br2NO2
MW:359.013361692429
CID:842104
PubChem ID:49758162
Update Time:2025-04-19

Ethyl 4,6-dibromoquinoline-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4,6-dibromoquinoline-3-carboxylate
    • 4,6-dibromo-3-Quinolinecarboxylic acid ethyl ester
    • 4,6-Dibromoquinoline-3-carboxylic acid ethyl ester
    • ACT10424
    • AK101772
    • ANW-62689
    • CTK8B9543
    • MolPort-017-263-315
    • DTXSID00677913
    • MFCD16987491
    • DA-19498
    • AKOS016004097
    • 1242260-51-0
    • SB72844
    • Ethyl4,6-dibromoquinoline-3-carboxylate
    • MDL: MFCD16987491
    • Inchi: 1S/C12H9Br2NO2/c1-2-17-12(16)9-6-15-10-4-3-7(13)5-8(10)11(9)14/h3-6H,2H2,1H3
    • InChI Key: VVAKXJZEXZQQIS-UHFFFAOYSA-N
    • SMILES: BrC1C(C(=O)OCC)=CN=C2C=CC(=CC2=1)Br

Computed Properties

  • Exact Mass: 358.898
  • Monoisotopic Mass: 356.9
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 288
  • 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
  • Topological Polar Surface Area: 39.2A^2
  • XLogP3: 3.8

Experimental Properties

  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 403.8±40.0 °C at 760 mmHg
  • Flash Point: 198.0±27.3 °C
  • Vapor Pressure: 0.0±0.9 mmHg at 25°C

Ethyl 4,6-dibromoquinoline-3-carboxylate Security Information

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