317319-14-5

Basic information

• Product Name: Benzenecarbothioamide, 3,4-difluoro- (9CI)
• Synonyms: Benzenecarbothioamide, 3,4-difluoro- (9CI);3,4-difluorobenzothioamide;Benzenecarbothioamide,3,4-difluoro-;3,4-difluorobenzothioamide(WXC04418)
• CAS NO: 317319-14-5
• Molecular Formula: C7H5F2NS
• Molecular Weight: 173.1831064
• Product Categories: THIOAMIDE
• Mol File: 317319-14-5.mol
• Article Data: 3

Chemical Properties

• Appearance: /
• CAS DataBase Reference: Benzenecarbothioamide, 3,4-difluoro- (9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: Benzenecarbothioamide, 3,4-difluoro- (9CI)(317319-14-5)
• EPA Substance Registry System: Benzenecarbothioamide, 3,4-difluoro- (9CI)(317319-14-5)

Safety Data

• Hazardous Substances Data: 317319-14-5(Hazardous Substances Data)

Upstream product

• 85118-04-3 (3,4-difluoro-phenyl)-amide 
• 64248-62-0 3,4-Difluorobenzonitrile 

Downstream Products

• 1569066-12-1 6-(2-(3,4-difluorophenyl)thiazol-4-yl)benzo[d]oxazol-2(3H)-one 

Relevant articles and documents

FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE

The present invention provides compounds of formula (I) and pharmaceutically acceptable salts, hydrates and solvates thereof for use in the treatment of cancer:

Reactions of some ortho and para halogenated aromatic nitriles with ethylenediamine: Selective synthesis of imidazolines

The reaction of ethylenediamine (EDA) with ortho and/or para halogenated benzonitriles did not lead to the imidazolines expected: a competitive aromatic nucleophilic substitution (SNAr) was observed instead. The selective synthesis of these imidazolines was performed by nucleophilic addition of EDA to thiobenzamide derivatives. The difference in reactivity between the nitrile and thioamide derivatives was estimated by a frontier orbital approach at the RHF/6-31G** level which predicted a greater reactivity of substituted thiobenzamides towards the nucleophilic addition of EDA.