Cas no 220844-77-9 (Ethyl 6-bromoquinoline-4-carboxylate)

Ethyl 6-bromoquinoline-4-carboxylate is a brominated quinoline derivative with significant utility in organic synthesis and pharmaceutical research. The compound features a carboxylate ester group at the 4-position and a bromine substituent at the 6-position, enhancing its reactivity for further functionalization. Its structure makes it a valuable intermediate in the preparation of more complex heterocyclic compounds, particularly in medicinal chemistry for the development of bioactive molecules. The bromine moiety allows for selective cross-coupling reactions, while the ester group offers versatility for hydrolysis or transesterification. This compound is characterized by high purity and stability, ensuring reliable performance in synthetic applications.
Ethyl 6-bromoquinoline-4-carboxylate structure
220844-77-9 structure
Product Name:Ethyl 6-bromoquinoline-4-carboxylate
CAS No:220844-77-9
MF:C12H10BrNO2
MW:280.117302417755
MDL:MFCD23135803
CID:1038338
PubChem ID:53990301
Update Time:2025-05-27

Ethyl 6-bromoquinoline-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 6-bromoquinoline-4-carboxylate
    • AK100839
    • ANW-69881
    • CTK8C3262
    • KB-253808
    • SureCN7365268
    • KEJQXBCGUDOZMU-UHFFFAOYSA-N
    • 1188AB
    • SB16082
    • AX8241752
    • ST24025037
    • DTXSID40708199
    • Ethyl6-bromoquinoline-4-carboxylate
    • DB-091539
    • A878743
    • DS-3629
    • SCHEMBL7365268
    • MFCD23135803
    • P13870
    • VIA84477
    • 220844-77-9
    • AKOS016001575
    • C12H10BrNO2
    • MDL: MFCD23135803
    • Inchi: 1S/C12H10BrNO2/c1-2-16-12(15)9-5-6-14-11-4-3-8(13)7-10(9)11/h3-7H,2H2,1H3
    • InChI Key: KEJQXBCGUDOZMU-UHFFFAOYSA-N
    • SMILES: BrC1C=CC2C(C=1)=C(C(=O)OCC)C=CN=2

Computed Properties

  • Exact Mass: 278.98949g/mol
  • Monoisotopic Mass: 278.98949g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 259
  • 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: 39.2
  • XLogP3: 3.1

Ethyl 6-bromoquinoline-4-carboxylate Security Information

  • Signal Word:Warning
  • Hazard Statement: H302
  • Warning Statement: P280-P305+P351+P338
  • Storage Condition:Sealed in dry,Room Temperature

Ethyl 6-bromoquinoline-4-carboxylate Pricemore >>

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