4-isothiocyanato-2-(trifluoromethyl)benzonitrile

Product Name 4-isothiocyanato-2-(trifluoromethyl)benzonitrile
Alternate Names Enzalutamide Impurities, Impurities of Enzalutamide
CAT No. CS-O-32106
CAS No. 143782-23-4
Category Impurities
Stock IN-Stock
Mol. Wt. 228.19 g/mol
Mol. For. C₉H₃F₃N₂S
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Enzalutamide
Purity >98%
Therapeutic Anti-Cancer / Oncology
Smileys FC(F)(C(C=C(N=C=S)C=C1)=C1C#N)F
Canonical Smiles C1=CC(=C(C=C1N=C=S)C(F)(F)F)C#N
InchIKey TYXKOMAQTWRDCR-UHFFFAOYSA-N
Inchl InChI=1S/C9H3F3N2S/c10-9(11,12)8-3-7(14-5-15)2-1-6(8)4-13/h1-3H
IUPAC 4-isothiocyanato-2-(trifluoromethyl)benzonitrile
Controlled No
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4-isothiocyanato-2-(trifluoromethyl)benzonitrile is a chemical compound that is commonly used in the pharmaceutical industry as a building block for synthesizing various pharmaceutical drugs. This compound is a member of the benzonitrile family of compounds and has the chemical formula C9H3F3N2S. The compound is a white crystalline powder that is sparingly soluble in water but highly soluble in organic solvents such as ethanol, acetone, and chloroform. It has a melting point of around 90-92°C and a boiling point of around 273°C. In terms of its chemical properties, 4-isothiocyanato-2-(trifluoromethyl)benzonitrile is a reactive compound that can undergo reactions such as nucleophilic substitution and addition reactions. Its isothiocyanate group makes it a useful reagent for the synthesis of various organic molecules that contain thiourea or isothiocyanate functional groups. The compound is also known to have some biological activity and has been studied for its potential use as an anti-cancer agent. It has been found to inhibit the growth of cancer cells in vitro, although further studies are needed to determine its efficacy in vivo. In conclusion, 4-isothiocyanato-2-(trifluoromethyl)benzonitrile is a versatile compound that has a wide range of applications in the pharmaceutical and chemical industries. Its unique chemical properties make it a valuable building block for synthesizing various organic molecules, and its potential biological activity makes it an interesting compound to study for its potential therapeutic uses.

Related Compounds

Enzalutamide Impurity 21 | N-((4-cyano-3-(trifluoromethyl)phenyl)carbamothioyl)benzamide | Enzalutamide Impurity 19 | N-Desmethyl Oxo-Enzalutamide | N-Nitroso Enzalutamide intermediate (Mixture of isomers) | Enzalutamide Impurity F | Enzalutamide replace methylamine fragment | Enzalutamide Ethyl ester Impurity | Enzalutamide Impurity 13 | Enzalutamide Impurity J | Enzalutamide Impurity D | Enzalutamide Ethylester impurity | Enzalutamide Impurity 46 | O-methyl (4-cyano-3-(trifluoromethyl)phenyl)carbamothioate | Enzalutamide Impurity 11 | Enzalutamide Impurity G | Enzalutamide Impurity K | Enzalutamide Impurity E | Enzalutamide Impurity 8 | Enzalutamide Impurity D | Enzalutamide Impurity C | N-[4-cyano-3-(trifluoromethyl) phenyl]-4-{3-[4-cyano-3-(trifluoromethyl) phenyl]-5, 5-dimethyl- 4-ox | Enzalutamide Impurity L | Enzalutamide Impurity H | Enzalutamide Impurity O | Enzalutamide Related Compound-D | Enzalutamide Related Compound-C | Enzalutamide Impurity I | Enzalutamide Impurity C | Enzalutamide carboxylic acid analogue | Methyl N,N’-Bis [4-cyano-3 -(trifluoromethyl)phenyl]cabamide |

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