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4-isothiocyanato-2-(trifluoroMethyl)benzonitrile

	4-isothiocyanato-2-(trifluoroMethyl)benzonitrile Structure
CAS No.
143782-23-4
Chemical Name:
4-isothiocyanato-2-(trifluoroMethyl)benzonitrile
Synonyms
4-isothiocyanato-2-(trifluoroMethyl)benzonitrile;D3-EZ-S2;4-Isothiocyanato-2;Enzalutamide Impurity Z;Enzalutamide Impurity 21;Enzalutamide Impurity N7;Enzalutamide intermediate;-Fluoro-4-methylphenylisothiocyanate;4-isothiocyano-2 -(trixenon methyl) benzol;4-cyano-3-trifluoromenthylphenylisothiocyanate
CBNumber:
CB21107300
Molecular Formula:
C9H3F3N2S
Molecular Weight:
228.19
MOL File:
143782-23-4.mol
MSDS File:
SDS
Modify Date:
2024/8/30 16:37:05

4-isothiocyanato-2-(trifluoroMethyl)benzonitrile Properties

Melting point 39.0 to 43.0 °C
Boiling point 331℃
Density 1.31
Flash point 154℃
storage temp. Inert atmosphere, 2-8°C
solubility Chloroform (Sparingly), DMSO (Sparingly), Methanol (Slightly)
form powder to lump
color White to Yellow to Green
Stability Hygroscopic, Moisture sensitive
InChI InChI=1S/C9H3F3N2S/c10-9(11,12)8-3-7(14-5-15)2-1-6(8)4-13/h1-3H
InChIKey TYXKOMAQTWRDCR-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(N=C=S)C=C1C(F)(F)F
CAS DataBase Reference 143782-23-4

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319-H227
Precautionary statements  P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235
HS Code  2929100090
NFPA 704
0
2 0

4-isothiocyanato-2-(trifluoroMethyl)benzonitrile price More Price(2)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TCI Chemicals (India) I0987 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile min. 98.0 % 143782-23-4 1G ₹4700 2022-05-26 Buy
TCI Chemicals (India) I0987 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile min. 98.0 % 143782-23-4 5G ₹16300 2022-05-26 Buy
Product number Packaging Price Buy
I0987 1G ₹4700 Buy
I0987 5G ₹16300 Buy

4-isothiocyanato-2-(trifluoroMethyl)benzonitrile Chemical Properties,Uses,Production

Uses

4-Isothiocyanoyl-2-(trifluoromethyl)benzonitrile is a reagent used to synthesize thioimidazolinone compounds and is a potential anti-prostate cancer drug. It is also used as an intermediate of enzalutamide.

Synthesis

Synthesis_143782-23-4
4-Amino-2-trifluoromethylbenzonitrile, (2.23 g, 12 mmol) was added portionwise over15 minutes into the well-stirred heterogeneous mixture of thiophosgene (1 ml, 13 mmol) in water (22 ml) at room temperature. Stirring was continued for an additional 1 h. The reaction medium was extracted with chloroform (3 x 15 ml). The combined organic phase was dried over MgSO4 and evaporated to dryness under reduced pressure to yield desired product, 4-isothiocyanato-2-trifluoromethylbenzonitrile, (Ia), as brownish solid and was used as such for the next step (2.72 g, 11.9 mmol, 99%).

4-isothiocyanato-2-(trifluoroMethyl)benzonitrile Preparation Products And Raw materials

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Benzonitrile,4-isothiocyanato-2-(trifluoroMethyl)- 3. 4-Isothiocyanato-2-(trifluoroMethyl)benzonitrile 4-cyano-3-trifluoromenthylphenylisothiocyanate 4-Isothiocyanato-2-(trifluoromethyl)benzonitrile,Enzalutamide intermediate 4-isothiocyananto-2-(trifluoromethyl) benzonitrile 4-ISOTHIOCYANATO-2-(TRIFLUOROMETHYL)BENZONITRILE/4-CYANO-3-TRIFLUOROMETHYLPHENYLISOTHIOCYANATE /CAS NO: 143782-23-4 Enzalutamide intermediate Enzalutamide Impurity Z Benzonitrile 4-Isothiocyanato-2-trifluoromethyl-2-fluoro-4-isothiocyanato1-methylbenzeneQ: What is Benzonitrile 4-Isothiocyanato-2-trifluoromethyl-2-fluoro-4-isothiocyanato1-methylbenzene Q: What is the CAS Number of Benzonitrile 4-Isothiocyanato-2-trifluoromethyl-2-fluoro-4-isothiocyanato1-methylbenzene Q: What is the storage condition of Benzonitrile 4-Isothiocyanato-2-trifluoromethyl-2-fluoro-4-isothiocyanato1-methylbenzene Q: What are the applications of Benzonitrile 4-Isothiocyanato-2-trifluoromethyl-2-fluoro-4-isothiocyanato1-methylbenzene 4-Isothiocyanato-2 Isothiocyanato-2-(trifluoromethyl)benzonitrile 4-ISOTHIOCYANATO-2-(TRIFLUOROMETHYL)BENZONITRILE (CAS : 143782-23-4) (intermediate of Enzalutamide) 4-isothiocyanoyl-2 - (trifluoromethyl) benzonitrile Enzalutamide Impurity 21 Isothiocyanic Acid 4-Cyano-3-(trifluoromethyl)phenyl Ester 4-isothiocyanato-2-(trifluoroMethyl)benzonitrile 4-isothiocyano-2 - (trifluoromethyl) benzonitrile 4-isothiolamino-2-(trifluoromethyl)benzene Melonitrile -Fluoro-4-methylphenylisothiocyanate 4-Cyano-3-(trifluoromethyl)phenylIsothiocyanate,98% 4-isothiocyano-2 -(trixenon methyl) benzol Enzalutamide Impurity N7 4-cyano-3-trifluoromenthylphenylisothiocyaChemicalbooknate 4-Isothiocvanato-2-(trifluoromethyl)benzonitrile D3-EZ-S2 143782-23-4 123782-23-4 143782-23-4