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CS-W001157 4
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2-Bromo-4-chloro-5-nitropyridine

  • CAS No. 1137475-57-0

  • Cat. No. CS-0102453
  • Purity≥96%
  • MDL No.MFCD17014975

*For research and further manufacturing use only, not for direct human use.

2-Bromo-4-chloro-5-nitropyridine|CS-0102453

Structure of 1137475-57-0

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General Information

  • CAS No. 1137475-57-0
  • Cat. No. CS-0102453
  • Purity ≥96%
  • MDL No. MFCD17014975
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₂BrClN₂O₂
  • Molecular Weight 237.44
  • Synonym(s) 2-bromo-4-chloro-5-nitro-pyridine
  • SMILES O=[N+](C1=CN=C(Br)C=C1Cl)[O-]

Description

2-Bromo-4-chloro-5-nitropyridine features a tri-functional pyridine core with distinct halogen and nitro substituents, enabling selective cross-coupling and functionalization. The electron-deficient ring facilitates palladium-catalyzed reactions, while the bromo and chloro groups offer orthogonal reactivity for sequential transformations. This compound serves as a key intermediate in medicinal chemistry and agrochemical synthesis, where precise molecular editing is essential.

Application

2-Bromo-4-chloro-5-nitropyridine serves as a versatile building block for the synthesis of functionalized pyridine derivatives. Its orthogonal halogenation pattern enables sequential cross-coupling reactions, facilitating the construction of complex heterocyclic scaffolds. The nitro group provides a handle for reduction and subsequent derivatization, while the molecule exhibits good bench stability and ease of purification, making it suitable for iterative synthetic workflows in medicinal chemistry and process development.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   56.03
  • LogP   2.4057
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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