CAS 16588-74-2

3,5-Bis(trifluoromethyl)phenyl isocyanate

Description:

3,5-Bis(trifluoromethyl)phenyl isocyanate is a chemical compound characterized by the presence of an isocyanate functional group (-N=C=O) attached to a phenyl ring that has two trifluoromethyl groups (-CF3) in the 3 and 5 positions. This structure imparts significant reactivity, particularly in nucleophilic addition reactions, making it useful in the synthesis of various polymers and pharmaceuticals. The trifluoromethyl groups enhance the compound's lipophilicity and stability, while also contributing to its unique electronic properties. Typically, this compound is a colorless to pale yellow liquid or solid, depending on temperature and purity. It is important to handle it with care due to its potential toxicity and reactivity, especially towards moisture, which can lead to the release of carbon dioxide and formation of urea derivatives. As with many isocyanates, appropriate safety measures should be taken to avoid inhalation or skin contact, as it can cause respiratory irritation and sensitization.

Formula: C₉H₃F₆NO

InChI: InChI=1S/C9H3F6NO/c10-8(11,12)5-1-6(9(13,14)15)3-7(2-5)16-4-17/h1-3H

InChI key: InChIKey=NRSSOFNMWSJECS-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=CC(C(F)(F)F)=CC(N=C=O)=C1

Synonyms:

• 1-Isocyanato-3,5-Bis(Trifluoromethyl)Benzene
• 3,5-Bis(trifluoromethyl)phenyl isocyanate 97%
• 3,5-Bis(trifluoromethyl)phenylisocyanate97%
• 3,5-Di(Trifluoromethyl)Phenylisocyanate
• 3,5-Di(trifluoromethyl)phenyl isocyanate
• Benzene, 1-isocyanato-3,5-bis(trifluoromethyl)-
• Isocyanic acid, α,α,α,α′,α′,α′-hexafluoro-3,5-xylyl ester
• 3,5-Bis(trifluoromethyl)phenyl isocyanate

3,5-Bis(trifluoromethyl)phenyl Isocyanate

CAS: 16588-74-2

Formula: C₉H₃F₆NO

Purity: >98.0%(GC)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 255.12

Ref: 3B-I0766

3,5-Bis(trifluoromethyl)phenyl isocyanate, 98%

CAS: 16588-74-2

3,5-Bis(trifluoromethyl)phenyl isocyanate is used in Chemical derivatization of amino-functionalized model surfaces. Preparation of arylaminothiocarbonylpyridinium zwitterionic salts, via an exothermic reaction with 4-pyrrolidinopyridine. Synthesis of (S)-3-hydroxymethyl-2-methoxymethoxy-2?-(3-(3,5-

Formula: C₉H₃F₆NO

Purity: 98%

Color and Shape: Clear colorless to pale yellow, Liquid

Molecular weight: 255.12

Ref: 02-L09582

3,5-Di(trifluoromethyl)phenyl isocyanate

CAS: 16588-74-2

Formula: C₉H₃F₆NO

Purity: 98%

Color and Shape: Liquid

Molecular weight: 255.1166

Ref: IN-DA001WET

3,5-Bis(trifluoromethyl)phenylisocyanate

CAS: 16588-74-2

Formula: C₉H₃F₆NO

Purity: 95.0%

Color and Shape: Liquid, Clear colourless to almost colourless liquid

Molecular weight: 255.119

Ref: 10-F050855

3,5-Bis(trifluoromethyl)phenyl isocyanate

CAS: 16588-74-2

3,5-Bis(trifluoromethyl)phenyl isocyanate

Formula: C₉H₃F₆NO

Purity: 98%

Color and Shape: clear. colourless liquid

Molecular weight: 255.12g/mol

Ref: 54-PC3115A