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CS-W001157 4
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Methyl 2-hydroxy-5-(trifluoromethyl)benzoate

  • CAS No. 1261478-26-5

  • Cat. No. CS-0132519
  • Purity≥95%
  • MDL No.None

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

Methyl 2-hydroxy-5-(trifluoromethyl)benzoate|CS-0132519

Structure of 1261478-26-5

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General Information

  • CAS No. 1261478-26-5
  • Cat. No. CS-0132519
  • Purity ≥95%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇F₃O₃
  • Molecular Weight 220.15
  • Synonym(s) None
  • SMILES O=C(OC)C1=CC(C(F)(F)F)=CC=C1O

Description

Methyl 2-hydroxy-5-(trifluoromethyl)benzoate features a trifluoromethyl group that imparts enhanced electron-withdrawing character and metabolic stability. The phenolic hydroxyl and ester functionalities enable selective derivatization in synthetic sequences. This compound serves as a key building block for bioactive molecules and functional materials under standard conditions.

Application

Methyl 2-hydroxy-5-(trifluoromethyl)benzoate serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzoic acid derivatives. The ortho-hydroxyl group facilitates directed metalation and cyclization reactions, while the trifluoromethyl moiety enhances metabolic stability and lipophilicity. Its bench-stable nature and compatibility with standard coupling and functionalization protocols make it ideal for iterative synthesis 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

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.1976
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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