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(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol

  • CAS No. 133775-25-4

  • Cat. No. CS-M3126
  • Purity≥98%
  • MDL No.MFCD28902278

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

(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol|CS-M3126

Structure of 133775-25-4

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General Information

  • CAS No. 133775-25-4
  • Cat. No. CS-M3126
  • Purity ≥98%
  • MDL No. MFCD28902278
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃F₂N₃O₂
  • Molecular Weight 269.25
  • Synonym(s) Efinaconazole intermediate
  • SMILES C[C@@H](O)[C@@](O)(C1=CC=C(F)C=C1F)CN2N=CN=C2

Description

This chiral diol features a (2R,3R)-configured core with a 1H-1,2,4-triazolyl group and a 2,4-difluorophenyl moiety, delivering enhanced metabolic stability and targeted bioactivity. The molecule integrates a hydrogen-bonding diol system with electron-deficient aromatic and heterocyclic components, enabling precise molecular recognition in medicinal chemistry applications.

Application

(2R,3R)-2-(2,4-Difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)butane-2,3-diol serves as a stereodefined diol building block for medicinal chemistry applications, enabling efficient construction of bioactive heterocyclic scaffolds. Its functional group tolerance and bench-stable nature facilitate downstream derivatization in coupling and cyclization reactions. The molecule’s defined stereochemistry supports reproducible structure–activity relationship studies.

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

Quality Control

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Computational Chemistry Data

  • TPSA   71.17
  • LogP   0.8249
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   4

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