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CS-W001157 4
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Ethyl 4-amino-2-(trifluoromethyl)benzoate

  • CAS No. 1171245-63-8

  • Cat. No. CS-0151832
  • Purity≥98%
  • MDL No.MFCD14698165

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

Ethyl 4-amino-2-(trifluoromethyl)benzoate|CS-0151832

Structure of 1171245-63-8

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General Information

  • CAS No. 1171245-63-8
  • Cat. No. CS-0151832
  • Purity ≥98%
  • MDL No. MFCD14698165
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀F₃NO₂
  • Molecular Weight 233.19
  • Synonym(s) None
  • SMILES CCOC(=O)C1=C(C=C(C=C1)N)C(F)(F)F

Description

Ethyl 4-amino-2-(trifluoromethyl)benzoate features a trifluoromethyl group that enhances electron-withdrawal and metabolic stability, while the para-amino functionality enables direct coupling in amidation or diazotization reactions. This bench-stable intermediate integrates efficiently into pharmaceutical scaffolds requiring polar, electron-deficient aryl cores.

Application

Ethyl 4-amino-2-(trifluoromethyl)benzoate serves as a versatile building block in medicinal chemistry, enabling the synthesis of biologically active heterocycles and pharmaceutical intermediates. Its amino and ester functionalities offer orthogonal reactivity for derivatization, while the electron-withdrawing trifluoromethyl group enhances metabolic stability and modulates lipophilicity. The compound exhibits excellent bench stability and is amenable to standard coupling, cyclization, and functional group transformation protocols.

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   52.32
  • LogP   2.4643
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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