79792-95-3

Basic information

• Product Name: 2-(propylthio)aniline
• Synonyms: 2-(propylthio)aniline;UKRORGSYN-BB BBV-084252;2-(propylthio)aniline(SALTDATA: HCl);2-(propylthio)aniline 1HCl
• CAS NO: 79792-95-3
• Molecular Formula: C₉H₁₃NS
• Molecular Weight: 167.27
• Mol File: 79792-95-3.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 268.3°C at 760 mmHg
• Flash Point: 116.1°C
• Appearance: /
• Density: 1.06g/cm³
• Vapor Pressure: 0.00775mmHg at 25°C
• Refractive Index: 1.581
• CAS DataBase Reference: 2-(propylthio)aniline(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(propylthio)aniline(79792-95-3)
• EPA Substance Registry System: 2-(propylthio)aniline(79792-95-3)

Safety Data

• Hazardous Substances Data: 79792-95-3(Hazardous Substances Data)

Usage

General Description

2-(propylthio)aniline is a chemical compound with the molecular formula C9H13NS. It is classified as an aniline derivative, containing a propylthio group attached to the aniline molecule. 2-(propylthio)aniline is used in various industrial processes, including as an intermediate in the synthesis of pharmaceuticals, dyes, and other organic compounds. It is also utilized in research and development for its chemical properties and potential applications. 2-(propylthio)aniline is considered to have low toxicity and is generally handled and used in accordance with standard laboratory safety practices.

InChI:InChI=1/C9H13NS/c1-2-7-11-9-6-4-3-5-8(9)10/h3-6H,2,7,10H2,1H3

Upstream product

• 76697-38-6 1-propylsulfanyl-2-nitrobenzene 
• 106-94-5 propyl bromide 
• 137-07-5 2-amino-benzenethiol 
• 4110-50-3 ethyl propyl sulfide 
• 622-37-7 Phenyl azide 
• 88-73-3 2-Chloronitrobenzene 
• 107-08-4 1-iodo-propane 

Downstream Products

• 52605-47-7 1-(2-propylmercapto-phenyl)-piperazine 
• 124769-55-7 N-(2-propylthiophenyl) guanidine 
• 102968-91-2 2-propylthio-N-allylaniline 
• 5325-20-2 2H-1,4-benzothiazin-3-one 
• 73153-65-8 N-[2-(propylthio)phenyl]benzamide 
• 685872-00-8 N'-[2-(propylthio)phenyl]benzamidine 
• 883-93-2 2-Phenylbenzothiazole 
• 74063-26-6 3-phenyl-4H-benzo[1,2,4]thiadiazine 
• 685872-24-6 3-phenyl-1-propyl-1λ⁴-benzo[1,2,4]thiadiazine 
• 124769-75-1 6-Oxo-2-(2-propylsulfanyl-phenylamino)-1,6-dihydro-pyrimidine-5-carboxylic acid 
• 124769-48-8 ethyl 1,6-dihydro-6-oxo-2-(2-propylthioanilino)-5-pyrimidinecarboxylate 
• 52605-50-2 3-[4-(2-propylmercapto-phenyl)-piperazino]-propylamine 
• 132647-24-6 3-[4-(2-propylmercapto-phenyl)-piperazino]-propan-1-ol 
• 860441-79-8 4-[4-(2-propylmercapto-phenyl)-piperazino]-butan-1-ol 

Relevant articles and documents

Visible-Light-Promoted Remote C-H Functionalization of o-Diazoniaphenyl Alkyl Sulfones

Visible-light irradiation of ortho-diazoniaphenyl alkyl sulfones in the presence of Ru(bpy)32+ results in remote Csp3-H functionalization. Key mechanistic steps in these processes involve intramolecular hydrogen atom transfer from Csp3-H bonds to aryl radicals to generate alkyl/benzyl radicals. Subsequent polar crossover occurs by single-electron oxidation of the alkyl/benzyl radicals to carbenium ions that then intercept nucleophiles. We have developed remote hydroxylations, etherifications, an amidation, and C-C bond formation processes using this strategy.

KF-alumina immobilized in ionic liquids: A novel heterogeneous base for heterocyclization of alkylsulfanylphenylamines into 1,4-benzothiazine

A rapid and convenient synthetic methodology for the cyclocondensative transformation of various alkylsulfanylphenylamines with bromoacetyl bromide by supporting on KF-alumina in ionic liquids [bmim] [Br] and [bmim][BF 4] has been developed to obtain 3-oxo-1,4-benzothiazine in good yields. The product is easily obtained by extraction with ethyl acetate and concentrating under vacuum. Easy recovery of ionic liquid and use in consecutive reactions is also reported.

Diagnostic radiopharmaceutical compounds (That)

Tetradentate ligands are used to form neutral 99m-technetium complexes which may be useful as radiopharmaceuticals e.g. as brain imaging agents. The ligands have the structure STR1 where n is 2 or 3, m is 0-4, R is H or substituted or unsubstituted C1 -C6 alkyl, provided that one CR2 group adjacent the starred nitrogen atom represents CO and forms with the adjacent N atom, a --CONH-- amide group, Y is unsubstituted or substituted C1 -C6 alkyl, and one of X and X' represents H or a labile thiol protecting group while the other is unsubstituted or substituted C1 -C6 alkyl, alkenyl or alkynyl.