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CS-W001157 4
Total: USD 88.00

Ethyl 3-amino-2,6-dichloroisonicotinate

  • CAS No. 458543-81-2

  • Cat. No. CS-0187405
  • Purity≥98%
  • MDL No.None

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

Ethyl 3-amino-2,6-dichloroisonicotinate|CS-0187405

Structure of 458543-81-2

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General Information

  • CAS No. 458543-81-2
  • Cat. No. CS-0187405
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈Cl₂N₂O₂
  • Molecular Weight 235.07
  • Synonym(s) None
  • SMILES CCOC(=O)C1=CC(=NC(=C1N)Cl)Cl

Description

Ethyl 3-amino-2,6-dichloroisonicotinate features a sterically hindered isonicotinate core with electron-deficient chlorine substituents at the 2- and 6-positions. The pendant amino group enables direct functionalization in late-stage synthesis, while the ethyl ester facilitates efficient derivatization. This compound delivers a robust platform for constructing bioactive heterocycles under standard conditions.

Application

Ethyl 3-amino-2,6-dichloroisonicotinate serves as a versatile building block in the synthesis of bioactive heterocycles and pharmaceutical intermediates. Its ortho-dichloro substitution enables selective functionalization, while the pendant amino and ester groups offer complementary reactivity for coupling, amidation, and cyclization reactions. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for scalable medicinal chemistry campaigns and API development workflows.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.21
  • LogP   2.1473
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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