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Atomfair 2-(Trifluoromethyl)phenyl isocyanate C8H4F3NO

Description 2-(Trifluoromethyl)phenyl isocyanate (CAS No. 2285-12-3) is a high-purity, reactive organic compound with the molecular formula C8H4F3NO . This aromatic isocyanate features a trifluoromethyl group ortho to the reactive isocyanate functionality, making it a valuable building block for specialized chemical synthesis. The compound is supplied as a clear to pale yellow liquid with a characteristic pungent odor, and is typically packaged under inert gas to ensure stability. With a molecular weight of 187.12 g/mol, this reagent offers excellent reactivity for nucleophilic addition reactions while the electron-withdrawing trifluoromethyl group enhances its utility in creating fluorinated derivatives. Suitable for use in pharmaceutical…

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Description

Description

2-(Trifluoromethyl)phenyl isocyanate (CAS No. 2285-12-3) is a high-purity, reactive organic compound with the molecular formula C8H4F3NO. This aromatic isocyanate features a trifluoromethyl group ortho to the reactive isocyanate functionality, making it a valuable building block for specialized chemical synthesis. The compound is supplied as a clear to pale yellow liquid with a characteristic pungent odor, and is typically packaged under inert gas to ensure stability. With a molecular weight of 187.12 g/mol, this reagent offers excellent reactivity for nucleophilic addition reactions while the electron-withdrawing trifluoromethyl group enhances its utility in creating fluorinated derivatives. Suitable for use in pharmaceutical intermediates, agrochemicals, and advanced material science applications, this product is rigorously tested for purity (typically ??97% by GC) and is available in research quantities up to bulk scale. Proper handling precautions are required due to its moisture sensitivity and potential respiratory irritant properties.

  • CAS No: 2285-12-3
  • Molecular Formula: C8H4F3NO
  • Molecular Weight: 187.12
  • Exact Mass: 187.02449824
  • Monoisotopic Mass: 187.02449824
  • IUPAC Name: 1-isocyanato-2-(trifluoromethyl)benzene
  • SMILES: C1=CC=C(C(=C1)C(F)(F)F)N=C=O
  • Synonyms: 2-(Trifluoromethyl)phenyl isocyanate, 1-Isocyanato-2-(trifluoromethyl)benzene, alpha,alpha,alpha-Trifluoro-o-tolyl isocyanate, o-(Trifluoromethyl)phenyl isocyanate, UWK587J8BW

Application

2-(Trifluoromethyl)phenyl isocyanate serves as a key intermediate in the synthesis of fluorinated ureas and carbamates for pharmaceutical applications. The compound is particularly valuable in creating bioactive molecules where the trifluoromethyl group enhances metabolic stability and lipophilicity. Researchers utilize this isocyanate in the development of enzyme inhibitors and receptor modulators in medicinal chemistry programs. It also finds application in materials science for modifying polymer backbones to introduce fluorinated aromatic moieties.

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