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Ethyl 2-(aminomethyl)isonicotinate hydrochloride

  • CAS No. 1189983-26-3

  • Cat. No. CS-0089760
  • Molecule weight216.66
  • Purity≥97%
  • MDL No.MFCD09788627

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

Ethyl 2-(aminomethyl)isonicotinate hydrochloride|CS-0089760

Structure of 1189983-26-3

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General Information

  • CAS No. 1189983-26-3
  • Cat. No. CS-0089760
  • Purity ≥97%
  • MDL No. MFCD09788627
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₃ClN₂O₂
  • Molecular Weight 216.66
  • Synonym(s) isonicotinate hydrochloride
  • SMILES O=C(OCC)C1=CC=NC(CN)=C1.Cl

Description

Ethyl 2-(aminomethyl)isonicotinate hydrochloride features a pyridine ring bearing both an ethyl ester and a primary amine-functionalized side chain, enabling direct incorporation into peptide-like scaffolds. The protonated amine enhances solubility in aqueous media while maintaining stability under standard bench conditions. This derivative serves as a key intermediate for bioactive heterocycles and functionalized building blocks in medicinal chemistry.

Application

Ethyl 2-(aminomethyl)isonicotinate hydrochloride serves as a versatile building block for the synthesis of pyridine-based pharmaceutical intermediates. The compound features a readily functionalized aminomethyl group ortho to an ester, enabling efficient derivatization via alkylation, amidation, or reductive amination. Its hydrochloride salt enhances bench stability and solubility in polar solvents, facilitating purification and integration into multi-step synthetic sequences.

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   1.1388
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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