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Methyl 3-amino-5-bromopyridine-2-carboxylate

  • CAS No. 1072448-08-8

  • Cat. No. CS-0049130
  • Purity≥97%
  • MDL No.None

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

Methyl 3-amino-5-bromopyridine-2-carboxylate|CS-0049130

Structure of 1072448-08-8

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General Information

  • CAS No. 1072448-08-8
  • Cat. No. CS-0049130
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇BrN₂O₂
  • Molecular Weight 231.05
  • Synonym(s) Methyl 3-amino-5-bromopicolinate
  • SMILES COC(=O)C1=NC=C(Br)C=C1N

Description

Methyl 3-amino-5-bromopyridine-2-carboxylate features a pyridine core bearing amino, bromo, and ester functionalities in a regioselective arrangement. This electron-rich heterocycle integrates readily into synthetic sequences requiring orthogonal reactivity, offering enhanced solubility and stability under standard conditions.

Application

Methyl 3-amino-5-bromopyridine-2-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling efficient access to pyridine-based scaffolds through palladium-catalyzed cross-coupling and electrophilic substitution reactions. The ortho-amino and bromo groups provide complementary sites for sequential functionalization, while the ester moiety supports further derivatization. Bench-stable and readily purified by recrystallization, it functions reliably in medicinal chemistry campaigns and API intermediate 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 : P233-P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   65.21
  • LogP   1.2129
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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