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CS-W001157 4
Total: USD 88.00

2-(3,5-Dichlorophenyl)thiazole-4-carboxylic acid

  • CAS No. 1178420-52-4

  • Cat. No. CS-0196535
  • Molecule weight274.12
  • Purity≥98%
  • MDL No.None

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

2-(3,5-Dichlorophenyl)thiazole-4-carboxylic acid|CS-0196535

Structure of 1178420-52-4

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General Information

  • CAS No. 1178420-52-4
  • Cat. No. CS-0196535
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₅Cl₂NO₂S
  • Molecular Weight 274.12
  • Synonym(s) 2-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxylic acid
  • SMILES C1=C(C=C(C=C1Cl)Cl)C2=NC(=CS2)C(=O)O

Description

2-(3,5-Dichlorophenyl)thiazole-4-carboxylic acid features a rigid thiazole core flanked by electron-withdrawing dichlorophenyl and carboxylic acid groups, enabling robust integration into bioactive scaffolds. This moisture-tolerant, bench-stable compound facilitates direct coupling in medicinal chemistry campaigns requiring halogenated heterocycles.

Application

2-(3,5-Dichlorophenyl)thiazole-4-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of thiazole-based heterocycles with enhanced bioavailability. Its robust functional group tolerance facilitates downstream derivatization via amide coupling, esterification, and Suzuki-Miyaura cross-coupling reactions. The molecule exhibits excellent bench stability and is readily purified by recrystallization, making it ideal for high-throughput screening and process-scale applications.

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   50.19
  • LogP   3.8151
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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