Intermediates

(1S)-1-[3,5-Bis(trifluoromethyl)phenyl]ethanol

  • CAS No.225920-05-8
  • GradeIndustrial / Pharmaceutical
  • Availability● In Stock

High-purity chiral intermediate for the synthesis of antiemetic APIs such as Aprepitant and Fosaprepitant.

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Product Technical Details

Product Overview

(1S)-1-[3,5-Bis(trifluoromethyl)phenyl]ethanol is a high-value chiral building block widely employed in the pharmaceutical industry as a key intermediate in the synthesis of neurokinin-1 (NK1) receptor antagonists. This enantiomerically enriched compound features exceptional stereochemical integrity and serves as a critical precursor to active pharmaceutical ingredients (APIs) including Aprepitant (CAS 170729-80-3) and its water-soluble prodrug Fosaprepitant (CAS 172673-20-0).

Specifications

Molecular FormulaC₁₀H₈F₆O
Molecular Weight258.16 g/mol
AppearanceWhite or off-white powder
Assay (GC)≥99.0% (Typical: 99.9%)
Enantiomeric Excess (ee%)≥99.0% (Typical: 99.5%)
Melting Point50–53 °C
Loss on Drying≤0.5%
Density1.4 ± 0.1 g/cm³
Flash Point60.1 ± 25.9 °C

Industrial Applications

This compound is exclusively utilized as a chiral intermediate in advanced pharmaceutical manufacturing processes. Its rigid aromatic backbone bearing two electron-withdrawing trifluoromethyl groups enhances metabolic stability and binding affinity in final drug molecules. Key applications include:

  • Synthesis of Aprepitant, a first-in-class antiemetic used to prevent chemotherapy-induced nausea and vomiting.
  • Production of Fosaprepitant, the intravenous prodrug formulation offering rapid onset of action in clinical settings.
  • Serving as a stereochemically defined scaffold in medicinal chemistry campaigns targeting CNS disorders.

Manufactured under stringent GMP-compliant conditions, our product ensures batch-to-batch consistency, full traceability, and comprehensive documentation including Certificate of Analysis (COA) and safety data sheets. Packaging is available in 25 kg drums or customized configurations upon request. Store in a cool, dry, and well-ventilated area with the container tightly sealed to maintain stability and purity.