4-isothiocyanato-2-(trifluoroMethyl)benzonitrile
- 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
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 |
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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 |
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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 |
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
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
Raw materials
Preparation Products
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Mekong pharmaceuticals pvt ltd | +91-4035163894 +91-8008212221 | Telangana, India | 129 | 58 | Inquiry |
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