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Ethyl 4-amino-2-(methylthio)thiazole-5-carboxylate

  • CAS No. 39736-29-3

  • Cat. No. CS-D0868
  • Purity≥97%
  • MDL No.MFCD01830310

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

Ethyl 4-amino-2-(methylthio)thiazole-5-carboxylate|CS-D0868

Structure of 39736-29-3

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General Information

  • CAS No. 39736-29-3
  • Cat. No. CS-D0868
  • Purity ≥97%
  • MDL No. MFCD01830310
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀N₂O₂S₂
  • Molecular Weight 218.30
  • Synonym(s) ETHYL 4-AMINO-2-(METHYLTHIO)-1,3-THIAZOLE-5-CARBOXYLATE
  • SMILES NC1=C(C(OCC)=O)SC(SC)=N1

Description

Ethyl 4-amino-2-(methylthio)thiazole-5-carboxylate features a thiazole core functionalized with an electron-rich amino group and a moisture-tolerant methylthio substituent, enabling direct incorporation into heterocyclic scaffolds. This bench-stable derivative serves as a key intermediate in the synthesis of bioactive thiazole-based compounds, particularly within medicinal chemistry and agrochemical development workflows.

Application

Ethyl 4-amino-2-(methylthio)thiazole-5-carboxylate serves as a versatile building block in heterocyclic synthesis, enabling access to thiazole-based scaffolds prevalent in medicinal chemistry. The amino and methylthio groups offer orthogonal reactivity for derivatization, while the ester functionality supports transformations including hydrolysis, amidation, and coupling reactions. Bench-stable and readily purified by flash chromatography, it functions effectively in standard synthetic workflows requiring functional group tolerance and predictable reactivity.

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 : 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

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Computational Chemistry Data

  • TPSA   65.21
  • LogP   1.6239
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   3

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