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4-(Trifluoromethyl)phenyl isocyanate, 98%

Product Code. 11333246
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Product Code. 11333246 Supplier Thermo Scientific Alfa Aesar Supplier No. L12576.06
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CAS: 1548-13-6 | C8H4F3NO | 187.12 g/mol

4-(Trifluoromethyl)phenyl isocyanate has been used in the synthesis of fluorescent photoinduced electron transfer (PET) chemosensors and 2-ethyl-6-[(4-trifluoromethylphenylcarbamoyl)hydrazino]-benzo[de]iso-quinoline-1,3-dione, an amidourea-based sensor for anions. It has also been used in the synthesis of 1,8-naphthalimide based colorimetric and fluorescent sensor for anions.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
4-(Trifluoromethyl)phenyl isocyanate has been used in the synthesis of fluorescent photoinduced electron transfer (PET) chemosensors and 2-ethyl-6-[(4-trifluoromethylphenylcarbamoyl)hydrazino]-benzo[de]iso-quinoline-1,3-dione, an amidourea-based sensor for anions. It has also been used in the synthesis of 1,8-naphthalimide based colorimetric and fluorescent sensor for anions.

Solubility
It hydrolyzes in water.

Notes
Moisture sensitive. Incompatible with oxidizing agents, alcohols, amines and heat.
TRUSTED_SUSTAINABILITY

Chemical Identifiers

CAS 1548-13-6
Molecular Formula C8H4F3NO
Molecular Weight (g/mol) 187.12
MDL Number MFCD00002028
InChI Key QZTWVDCKDWZCLV-UHFFFAOYSA-N
Synonym 4-trifluoromethyl phenyl isocyanate, 1-isocyanato-4-trifluoromethyl benzene, alpha,alpha,alpha-trifluoro-p-tolyl isocyanate, 4-trifluoromethyl phenylisocyanate, 4-isocyanatobenzotrifluoride, 4-trifluoromethylphenyl isocyanate, benzene, 1-isocyanato-4-trifluoromethyl, p-trifluoromethylphenyl isocyanate, isocyanic acid 4-trifluoromethyl phenyl ester, 4-trifluoromethyl benzenisocyanate
PubChem CID 73768
IUPAC Name 1-isocyanato-4-(trifluoromethyl)benzene
SMILES FC(F)(F)C1=CC=C(C=C1)N=C=O

Spécification

Density 1.31
Boiling Point 91°C to 94°C (35 mmHg)
Flash Point 70°C (158°F)
Odor Pungent
Refractive Index 1.471
Quantity 5 g
UN Number UN2285
Beilstein 881041
Sensitivity Moisture sensitive
Solubility Information It hydrolyzes in water.
Formula Weight 187.12
Percent Purity 98%
Chemical Name or Material 4-(Trifluoromethyl)phenyl isocyanate
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Identifiant produit
  • 4-(Trifluoromethyl)phenyl isocyanate
Mention d'avertissement
  • Danger
Catégorie de danger
  • Acute toxicity Category 2
  • Acute toxicity Category 4
  • Serious eye damage/eye irritation Category 2
  • Respiratory sensitiser Category 1
  • Skin corrosion/irritation Category 2
  • Specific target organ toxicity Category 3
Mention de danger
  • H302-Harmful if swallowed.
  • H312-Harmful in contact with skin.
  • H315-Causes skin irritation.
  • H319-Causes serious eye irritation.
  • H330-Fatal if inhaled.
  • H334-May cause allergy or asthma symptoms or breathing difficulties if inhaled.
  • H335-May cause respiratory irritation.
Conseils de prudence
  • P261-Avoid breathing dust/fume/gas/mist/vapours/spray.
  • P280-Wear protective gloves/protective clothing/eye protection/face protection.
  • P301+P312-IF SWALLOWED: Call a POISON CENTER or doctor/physician/ if you feel unwell.
  • P302+P352-IF ON SKIN: Wash with plenty of water/soap.
  • P304+P340-IF INHALED: Remove person to fresh air and keep comfortable for breathing.
  • P305+P351+P338-IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P310-Immediately call a POISON CENTER/doctor/.
  • P342+P311-If experiencing respiratory symptoms: Call a POISON CENTER/doctor/ .
Informations supplémentaires
  • MIXTURE LIST-Contain: 4-(Trifluoromethyl)phenyl isocyanate

RUO – Research Use Only

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