4274-38-8

Basic information

• Product Name: 3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE HYDROCHLORIDE
• Synonyms: 3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE, HCL;3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE HYDROCHLORIDE;2-MERCAPTO-5-(TRIFLUOROMETHYL)ANILINE, HCL;2-AMINO-4-(TRIFLUOROMETHYL)BENZENETHIOL HYDROCHLORIDE;2-AMINO-4-(TRIFLUOROMETHYL)THIOPHENOL, HCL;2-AMINO-4-(TRIFLUOROMETHYL)THIOPHENOL HYDROCHLORIDE;LABOTEST-BB LT00452166;AT-BTF
• CAS NO: 4274-38-8
• Molecular Formula: C₇H₆F₃NS*ClH
• Molecular Weight: 229.65
• EINECS: 429-560-8
• Product Categories: Phenol&Thiophenol&Mercaptan;Organic Building Blocks;Sulfur Compounds;Thiols/Mercaptans
• Mol File: 4274-38-8.mol
• Article Data: 2

Chemical Properties

• Melting Point: 196-198 °C(lit.)
• Boiling Point: 241.5 °C at 760 mmHg
• Flash Point: 99.8 °C
• Appearance: white to light yellow crystal powder
• Density: 2.46
• Vapor Pressure: 3.35E-06mmHg at 25°C
• Sensitive: Hygroscopic
• BRN: 4273774
• CAS DataBase Reference: 3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE HYDROCHLORIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE HYDROCHLORIDE(4274-38-8)
• EPA Substance Registry System: 3-AMINO-4-MERCAPTOBENZOTRIFLUORIDE HYDROCHLORIDE(4274-38-8)

Safety Data

• Hazard Codes: Xn,T
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-37/39
• RIDADR: UN2811
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 4274-38-8(Hazardous Substances Data)

Usage

Chemical Properties

white to light yellow crystal powder

Uses

2-Amino-4-(trifluoromethyl)benzenethiol hydrochloride may be used in the synthesis of 6-trifluoromethyl-4H-1,4-benzothiazines, via condensation and oxidative cyclization with β-di-carbonyl compounds.

InChI:InChI=1/C9H10F3N5O.ClH/c10-9(11,12)18-6-3-1-5(2-4-6)16-8(15)17-7(13)14;/h1-4H,(H6,13,14,15,16,17);1H

Upstream product

• 860-39-9 bis(2-nitro-4-trifluoromethylphenyl) disulfide 
• 121-17-5 2-chloro-3-nitro-5-trifluoromethylbenzene 

Downstream Products

• 110704-50-2 5-trifluoromethyl-2-chloromethylbenzothiazole 
• 293316-23-1 (2-amino-4-trifluoromethylphenylsulfanyl)acetonitrile 
• 293316-24-2 N-(2-cyanomethylsulfanyl-5-trifluoromethylphenyl)acetamide 
• 821806-25-1 (2-cyanomethylsulfanyl-5-trifluoromethylphenyl)carbamic acid ethyl ester 
• 293316-25-3 N-(2-Cyanomethylsulfonyl-5-trifluoromethylphenyl)acetamide 
• 821806-22-8 (2-cyanomethanesulfonyl-5-trifluoromethyl-phenyl)-carbamic acid ethyl ester 
• 29308-83-6 8-trifluoromethyl-10H-dibenzo[b,f][1,4]thiazepin-11-one 
• 190328-50-8 2-(4-trifluoromethyl-2-aminophenylthio)-benzonitrile 
• 1125484-45-8 4-(4-isopropyl-phenyl)-6-prop-2-ynyloxy-2-(5-trifluoromethyl-benzothiazol-2-yl)-quinazoline 
• 1041166-86-2 3-(4-nitrophenyl)-6-(trifluoromethyl)-2H-1,4-benzothiazine 
• 1041166-84-0 3-phenyl-6-(trifluoromethyl)-2H-benzo[b][1,4]thiazine 
• 1041261-21-5 3-(4-methoxyphenyl)-6-(trifluoromethyl)-2H-1,4-benzothiazine 
• 1050481-64-5 2-(5-chloro-2-methoxyphenyl)-6-trifluoromethyl-2H-1,4-benzothiazin-3(4H)-one 
• 1050481-62-3 2-(5-bromo-2-methoxyphenyl)-6-trifluoromethyl-2H-1,4-benzothiazin-3(4H)-one 

Relevant articles and documents

Synthesis of 6-trifluoromethyl-4h-1,4-benzothiazines as possible anticancer agents

The synthesis of 6-trifluoromethyl-4H-1,4-benzothiazines is reported by the condensation and oxidative cyclization of 2-amino-4-trifluoromethylbenzenethiol hydrochloride with β-di- carbonyl compounds. All the newly synthesized compounds have been characte