Cas no 1214346-11-8 (Ethyl 5-bromo-2-chloroisonicotinate)

Ethyl 5-bromo-2-chloroisonicotinate is a halogenated pyridine derivative commonly employed as a versatile intermediate in pharmaceutical and agrochemical synthesis. Its key structural features—the bromo and chloro substituents on the pyridine ring—enhance reactivity in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, facilitating the construction of complex heterocyclic frameworks. The ethyl ester group further improves solubility and offers a handle for subsequent functionalization. This compound is particularly valued for its stability under standard storage conditions and its compatibility with a range of reaction conditions, making it a reliable building block for medicinal chemistry and material science applications.
Ethyl 5-bromo-2-chloroisonicotinate structure
1214346-11-8 structure
Product Name:Ethyl 5-bromo-2-chloroisonicotinate
CAS No:1214346-11-8
MF:C8H7BrClNO2
MW:264.503680467606
MDL:MFCD14698168
CID:1025287
PubChem ID:46311265
Update Time:2025-05-28

Ethyl 5-bromo-2-chloroisonicotinate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-bromo-2-chloroisonicotinate
    • Ethyl 5-bromo-2-chloroisonicotite
    • ethyl 5-bromo-2-chloropyridine-4-carboxylate
    • BCP22800
    • SCHEMBL15770624
    • Ethyl5-bromo-2-chloroisonicotinate
    • DTXSID40673252
    • SB55048
    • FE-0247
    • CS-0191832
    • BCP9000666
    • 5-bromo-2-chloroisonicotinic acid ethyl ester
    • Ethyl 2-chloro-5-bromopyridine-4-carboxylate
    • MFCD14698168
    • 1214346-11-8
    • 4-Pyridinecarboxylic acid, 5-bromo-2-chloro-, ethyl ester
    • J-400947
    • YVGLNIDGZXOBSZ-UHFFFAOYSA-N
    • DB-129267
    • 5-bromo-2-chloro-4-pyridinecarboxylic acid ethyl ester
    • AKOS015835844
    • A891740
    • MDL: MFCD14698168
    • Inchi: 1S/C8H7BrClNO2/c1-2-13-8(12)5-3-7(10)11-4-6(5)9/h3-4H,2H2,1H3
    • InChI Key: YVGLNIDGZXOBSZ-UHFFFAOYSA-N
    • SMILES: BrC1C=NC(=CC=1C(=O)OCC)Cl

Computed Properties

  • Exact Mass: 262.93500
  • Monoisotopic Mass: 262.93487g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 191
  • 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: 39.2?2

Experimental Properties

  • Density: 1.601±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Very slightly soluble (0.87 g/l) (25 o C),
  • PSA: 39.19000
  • LogP: 2.67420

Ethyl 5-bromo-2-chloroisonicotinate Security Information

  • HazardClass:IRRITANT

Ethyl 5-bromo-2-chloroisonicotinate Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Ethyl 5-bromo-2-chloroisonicotinate Pricemore >>

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