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3-(Trifluoromethyl)phenyl isocyanate

3-(Trifluoromethyl)phenyl isocyanate Suppliers list
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Products Intro: Product Name:3-(Trifluoromethyl)phenyl isocyanate
CAS:329-01-1
Purity:98%(Min,HPLC) Package:1G;1KG;100KG
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Products Intro: Product Name:3-(Trifluoromethyl)phenyl isocyanate
CAS:329-01-1
Purity:99% Package:25KG;5KG;1KG
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Products Intro: Product Name:3-(Trifluoromethyl)phenyl isocyanate
CAS:329-01-1
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Products Intro: CAS:329-01-1
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Products Intro: Product Name:3-(Trifluoromethyl)phenyl isocyanate
CAS:329-01-1
Purity:0.98 Package:1kg;5kg;25kg
3-(Trifluoromethyl)phenyl isocyanate Basic information
Synthesis
Product Name:3-(Trifluoromethyl)phenyl isocyanate
Synonyms:1-isocyanato-3-(trifluoromethyl)-benzen;1-Isocyanato-3-(trifluoromethyl)benzene;3-Trifluoromethylphenylcyanate;alpha,alpha,alpha-Trifluoro-3-tolyl isocyanate;alpha,alpha,alpha-Trifluoro-meta-tolylisocyanate;benzene-1-isocyanato-3-(trifluoromethyl)-;Isocyanic acid m-trifluoromethylphenyl ester;Isocyanic acid, alpha,alpha,alpha-trifluoro-m-tolyl ester
CAS:329-01-1
MF:C8H4F3NO
MW:187.12
EINECS:206-341-3
Product Categories:Phenyl isocyanate&Phenyl isothiocyanate
Mol File:329-01-1.mol
3-(Trifluoromethyl)phenyl isocyanate Structure
3-(Trifluoromethyl)phenyl isocyanate Chemical Properties
Melting point -26 °C
Boiling point 54 °C11 mm Hg(lit.)
density 1.359 g/mL at 25 °C(lit.)
vapor pressure 2.44 psi ( 20 °C)
refractive index n20/D 1.467(lit.)
Fp 138 °F
storage temp. Keep Cold
solubility soluble in Toluene
form clear liquid
color Colorless to Almost colorless
Specific Gravity1.359
Water Solubility 5.46g/L at 25℃
Sensitive Lachrymatory
BRN 744880
LogP2.04
CAS DataBase Reference329-01-1(CAS DataBase Reference)
NIST Chemistry ReferenceBenzene, 1-isocyanato-3-(trifluoromethyl)-(329-01-1)
EPA Substance Registry System3-Trifluoromethylphenyl isocyanate (329-01-1)
Safety Information
Hazard Codes Xn,T,T+
Risk Statements 20/22-37/38-42-36/37/38-26-21/22-22
Safety Statements 23-28-45-36/37/39-28A-26-36/37-22-9
RIDADR UN 3384 6.1/PG 1
WGK Germany 2
RTECS NR0200000
10
Hazard Note Toxic/Lachrymatory/Keep Cold
TSCA Yes
HazardClass 6.1
PackingGroup II
HS Code 29291090
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
3-(Trifluoromethyl)phenyl isocyanate Usage And Synthesis
Synthesis The preparation method is as follows: adding 3-trifluoromethylaniline and chlorobenzene to the reaction flask, stirring, mixing and dissolving it, cooling to 0-10° C., introducing dry hydrogen chloride to make it saturated, and then adding N,N-diisopropylamine. Butyl chloromethylamide, heated to 50°C and kept for 30min, and then introduced phosgene. After a certain amount of phosgene was introduced, the reaction was completed. Then the material is distilled and desolubilized to obtain the finished product.
Chemical Propertiescolorless to light yellow liquid
Uses3-?(Trifluoromethyl)?phenyl Isocyanate is a reagent used in the synthesis of heme-regulated inhibitor as selective activators of the eukaryotic inhibition factor Alpha (eIF2α) phosphorylation arm of the endoplasmic reticulum stress response. Influences cell proliferation, cell differentiaton and adaptation to stress. Also a reagent in the preparation of sorafenib derivatives.
Flammability and ExplosibilityNot classified
Safety ProfileModerately toxic by ingestion, inhalation, and intraperitoneal routes. A lachrymator. Flammable liquid when exposed to heat, sparks, or flame. When heated to decomposition it emits very toxic fumes of NOx and F-. See also ISOCYANATES and FLUORIDES.
Tag:3-(Trifluoromethyl)phenyl isocyanate(329-01-1) Related Product Information
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