96125-50-7

Basic information

• Product Name: (+/-)-trans-(2R,3S)-8-chloro-2,3-dihydro-3-hydroxy-2-(4'-methoxyphenyl)-1,5-benzothiazepin-4-[5H]-one
• Synonyms: (+/-)-trans-(2R,3S)-8-chloro-2,3-dihydro-3-hydroxy-2-(4'-methoxyphenyl)-1,5-benzothiazepin-4-[5H]-one
• CAS NO: 96125-50-7
• Molecular Weight: 335.811
• Mol File: 96125-50-7.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: (+/-)-trans-(2R,3S)-8-chloro-2,3-dihydro-3-hydroxy-2-(4'-methoxyphenyl)-1,5-benzothiazepin-4-[5H]-one(CAS DataBase Reference)
• NIST Chemistry Reference: (+/-)-trans-(2R,3S)-8-chloro-2,3-dihydro-3-hydroxy-2-(4'-methoxyphenyl)-1,5-benzothiazepin-4-[5H]-one(96125-50-7)
• EPA Substance Registry System: (+/-)-trans-(2R,3S)-8-chloro-2,3-dihydro-3-hydroxy-2-(4'-methoxyphenyl)-1,5-benzothiazepin-4-[5H]-one(96125-50-7)

Safety Data

• Hazardous Substances Data: 96125-50-7(Hazardous Substances Data)

Upstream product

• 23474-98-8 2-amino-5-chlorobenzenethiol 
• 105560-93-8 methyl (2R,3S)-3-(4-methoxyphenyl)glycidate 
• 14371-79-0 2-nitro-5-chlorothiophenol 
• 95-24-9 6-chloro-2-aminobenzothiazole 
• 130884-67-2 3-(2-Amino-5-chloro-phenylsulfanyl)-2-hydroxy-3-(4-methoxy-phenyl)-propionic acid 
• 96125-49-4 methyl trans-3-(4-methoxyphenyl)glycidate 
• 130979-64-5 3-(5-Chloro-2-nitro-phenylsulfanyl)-2-hydroxy-3-(4-methoxy-phenyl)-propionic acid methyl ester 
• 130979-65-6 3-(5-Chloro-2-nitro-phenylsulfanyl)-2-hydroxy-3-(4-methoxy-phenyl)-propionic acid 

Downstream Products

• 130979-60-1 (2R,3S)-8-Chloro-5-(2-dimethylamino-ethyl)-3-hydroxy-2-(4-methoxy-phenyl)-2,3-dihydro-5H-benzo[b][1,4]thiazepin-4-one 
• 130979-52-1 Acetic acid (2R,3S)-8-chloro-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester 

Relevant articles and documents

Facile ionic liquid-mediated protocol for the regioselective synthesis of 1,5-benzothiazepines

An efficient one-step ionic liquid-mediated green protocol for the regioselective synthesis of (+)=(±)-cis-2-(4-methoxy/benzyloxyphenyl)-3- hydroxy-2,3-dihydro-1,5- benzothiazepin-4-[5H]-ones has been developed from the reaction between substituted 2-aminobenzenethiol and methyl-(±)-trans-3- (4-methoxy/benzyloxy phenyl)glycidate, under nitrogen atmosphere, at 60±2 °C. The reaction has been performed in ionic liquids (viz, 1-butyl-3-methylimidazolium bromide/hexafluorophosphate), and the yields of the 1,5-benzothiazepine derivatives were found to be excellent. The cis-stereoisomer was obtained as the major product along with a trans-isomer as minor product.