1455-92-1

Basic information

• Product Name: 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole
• Synonyms: 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole;5-(METHYLTHIO)-1-PHENYL-1H-TETRAZOLE;TIMTEC-BB SBB006320;RARECHEM AQ NN 0456;5-(methylthio)-1-phenyl-tetrazole;5-methylsulfanyl-1-phenyl-1,2,3,4-tetrazole;5-methylsulfanyl-1-phenyltetrazole;5-Methylsulfanyl-1-phenyl-1H-tetrazole
• CAS NO: 1455-92-1
• Molecular Formula: C₈H₈N₄S
• Molecular Weight: 192.24
• Mol File: 1455-92-1.mol
• Article Data: 15

Chemical Properties

• Boiling Point: 363.1 °C at 760 mmHg
• Flash Point: 173.4 °C
• Appearance: /
• Density: 1.34g/cm³
• Vapor Pressure: 1.84E-05mmHg at 25°C
• Refractive Index: 1.697
• CAS DataBase Reference: 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole(CAS DataBase Reference)
• NIST Chemistry Reference: 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole(1455-92-1)
• EPA Substance Registry System: 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole(1455-92-1)

Safety Data

• Hazardous Substances Data: 1455-92-1(Hazardous Substances Data)

Usage

General Description

5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole is a chemical compound with the molecular formula C8H8N4S. It is a white to light yellow crystalline powder that is commonly used in the synthesis of pharmaceuticals and agrochemicals. 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole has been used in research as a potential anti-cancer agent due to its ability to inhibit the growth of cancer cells. It is also used in the production of dyes and pigments. Additionally, 5-(Methylthio)-1-phenyl-1H-1,2,3,4-tetraazole has been studied for its potential applications in the treatment of neurological disorders and as an antimicrobial agent. Overall, this compound has a range of potential uses in various industries due to its unique chemical properties and potential therapeutic applications.

InChI:InChI=1/C8H8N4S/c1-13-8-9-10-11-12(8)7-5-3-2-4-6-7/h2-6H,1H3

Upstream product

• 86-93-1 1-phenyl-1H-tetrazole-5-thiol 
• 60-29-7 diethyl ether 
• 74-88-4 methyl iodide 
• 64-17-5 ethanol 
• 141-52-6 sodium ethanolate 
• 77-78-1 dimethyl sulfate 
• 103-72-0 phenyl isothiocyanate 
• 86-93-1 1-Phenyl-1H-tetrazole-5-thiol 
• 2533-69-9 methyl 2,2,2-trichloroacetimidate 
• 616-38-6 carbonic acid dimethyl ester 
• 20389-38-2 1-Phenyl-5-mercaptotetrazol-Silber 
• 186581-53-3 diazomethane 

Downstream Products

• 3206-44-8 5-methanesulfonyl-1-phenyl-1H-tetrazole 
• 94201-87-3 5-Methylsulfanyl-1-(4-nitrophenyl)tetrazole 
• 97990-02-8 Toluene-4-sulfonate2-methyl-5-methylsulfanyl-4-phenyl-4H-tetrazol-2-ium; 
• 97990-06-2 Toluene-4-sulfonate1-methyl-5-methylsulfanyl-4-phenyl-4H-tetrazol-1-ium; 
• 74-93-1 methylthiol 
• 62-53-3 aniline 
• 5097-82-5 5-phenyl-1H-tetrazolone 
• 133088-47-8 5-methanesulfonyl-1-(4-nitrophenyl)-1H-tetrazole 
• 880634-13-9 5-[(bromomethyl)sulfonyl]-1-phenyl-1H-tetrazole 
• 54246-58-1 5-Methoxy-1-(4-nitrophenyl)tetrazole 
• 54246-59-2 5-isopropoxy-1-(4-nitro-phenyl)-1H-tetrazole 
• 75430-97-6 1-(4-nitrophenyl)-4,5-dihydro-1H-1,2,3,4-tetrazol-5-one 
• 291534-99-1 5-ethoxy-1-(4-nitrophenyl)tetrazole 
• 291535-00-7 5-butoxy-1-(4-nitro-phenyl)-1H-tetrazole 

Relevant articles and documents

Stereoselective synthesis of Z alkenyl halides via Julia olefination

Julia olefination between α-halomethyl sulfones and a variety of aldehydes afforded alkenyl halides in good to excellent yields with high E/Z stereoselectivities. Sulfones were readily prepared in two or three steps from commercially available reagents in good yields. Optimization revealed that the nature of the solvent, the base, and the additive were crucial to obtain the desired alkenyl halides.

Metal-Free Aminomethylation of Aromatic Sulfones Promoted by Eosin Y

A metal-free α-aminomethylation of heteroaryls promoted by eosin Y under green light irradiation is reported. A large variety of α-trimethylsilylamines as precursor of α-aminomethyl radical species were engaged to functionalize sulfonyl-heteroaryls following a Homolytic Aromatic Substitution (HAS) pathway. This method has provided a range of α-aminoheteroaryl compounds including a functionalized natural product. The mechanism of this late-stage functionalization of aryls was investigated and suggests the formation of a sulfonyl radical intermediate over a reductive quenching cycle.

Alkylation of thiols with trichloroacetimidates under neutral conditions

Trichloroacetimidates are displaced with thiols to form the corresponding sulfides without the need for an added acid or base by simply heating the reactants in refluxing THF. This operationally simple procedure provides the corresponding sulfides in excellent yields with only the formation of the neutral trichloroacetamide as the side product. The imidate may also be formed in situ, allowing for a direct method for the formation of sulfides from alcohols. This reaction provides a general method for the synthesis of a variety of sulfides from inexpensive and readily available alcohol starting materials.