3019-20-3

Basic information

• Product Name: ISOPROPYLTHIOBENZENE
• Synonyms: ISOPROPYL PHENYL SULPHIDE;ISOPROPYL PHENYL SULFIDE;ISOPROPYLTHIOBENZENE;(Isopropylsulfanyl)benzene;2-methyl-1-phenyl-1-thiapropane;Benzene, [(1-methylethyl)thio]-;benzene,(isoproylthio)-;sulfide,isopropylphenyl
• CAS NO: 3019-20-3
• Molecular Formula: C₉H₁₂S
• Molecular Weight: 152.26
• EINECS: 221-162-0
• Mol File: 3019-20-3.mol
• Article Data: 65

Chemical Properties

• Melting Point: -45°C (estimate)
• Boiling Point: 105°C 40mm
• Flash Point: 105°C/40mm
• Appearance: /
• Density: 0,985 g/cm3
• Vapor Pressure: 0.315mmHg at 25°C
• Refractive Index: 1.5465
• Sensitive: Stench
• BRN: 1906756
• CAS DataBase Reference: ISOPROPYLTHIOBENZENE(CAS DataBase Reference)
• NIST Chemistry Reference: ISOPROPYLTHIOBENZENE(3019-20-3)
• EPA Substance Registry System: ISOPROPYLTHIOBENZENE(3019-20-3)

Safety Data

• Statements: 20/21/22
• Safety Statements: 26-36/37/39
• Hazardous Substances Data: 3019-20-3(Hazardous Substances Data)

Usage

General Description

ISOPROPYLTHIOBENZENE is a chemical compound with the molecular formula C9H12S. It is classified as an aromatic compound and consists of a benzene ring attached to a thiol group and an isopropyl side chain. It is commonly used as a chemical intermediate in the production of various organic compounds, including pharmaceuticals, dyes, and pesticides. ISOPROPYLTHIOBENZENE is known for its distinct odor and is also employed as a fragrance ingredient in perfumes and personal care products. It is considered to be a relatively stable and non-reactive compound under normal conditions, but should still be handled with care due to its potential for skin and eye irritation.

InChI:InChI=1/C9H12S/c1-8(2)10-9-6-4-3-5-7-9/h3-8H,1-2H3

Upstream product

• 75-30-9 2-iodo-propane 
• 930-69-8 sodium thiophenolate 
• 1623-24-1 isopropylphosphoric acid 
• 108-98-5 thiophenol 
• 3111-52-2 potassium thiophenolate 
• 75-26-3 isopropyl bromide 
• 187737-37-7 propene 
• 13133-62-5 thiophenolate 
• 4848-62-8 Trimethyl(phenylthio)germane 
• 77111-62-7 isopropyl phenyl trithiocarbonate 
• 7205-62-1 1-chloro-4-(isopropylthio)benzene 
• 13291-18-4 isopropenylmagnesium bromide 
• 4170-69-8 isopropyl phenyl sulfoxide 
• 55698-06-1 m-chlorophenyl isopropyl sulfide 

Downstream Products

• 41394-95-0 2-isopropylmercaptobenzoic acid 
• 4238-09-9 phenyl isopropyl sulfone 
• 15893-11-5 (2-chloro-1-methyl-vinyl)-phenyl sulfide 
• 4074-53-7 1-[4-(propan-2-ylsulfanyl)phenyl]ethan-1-one 
• 103375-85-5 C₁₄H₁₆N₂S*C₆H₃N₃O₇ 
• 70398-84-4 1,2-Bisbenzene 
• 4170-69-8 isopropyl phenyl sulfoxide 
• 930-69-8 sodium thiophenolate 
• 4170-69-8 (R)-(isopropylsulfinyl)benzene 
• 80225-50-9 (S)-isopropyl phenyl sulfoxide 
• 101259-36-3 α-Chloro-α-methylethylphenylsulfide 
• 103375-76-4 C₁₆H₁₉NS*C₆H₃N₃O₇ 
• 103375-78-6 C₁₅H₁₆ClNS*C₆H₃N₃O₇ 
• 103375-81-1 C₁₇H₁₉NOS*C₆H₃N₃O₇ 

Relevant articles and documents

Regenerable Thiophenolic Radical-Trapping Antioxidants

Diphenyl disulfides carrying alkyltelluro groups in the o-, m-, and p-positions were prepared using ortho-lithiation and lithium halogen exchange reactions. The novel antioxidants showed only minimal inhibitory effect on the azo-initiated peroxidation of linoleic acid in chlorobenzene until reduced to the corresponding thiophenols by tris(2-carboxyethyl)phosphine (TCEP). The best in situ generated thiophenol (from 7c) under these conditions quenched peroxyl radicals more efficiently than α-tocopherol with an almost 3-fold increase in inhibition time.

Palladium complex containing meta-position carborane triazole ligand and preparation method and application of palladium complex

The invention relates to a palladium complex containing a meta-position carborane triazole ligand and a preparation method and application of the palladium complex. The palladium complex is prepared by the following steps: (1) dropwise adding an n-BuLi solution into a meta-position carborane m-C2B10H12 solution, carrying out stirring and reacting, then adding 3-propargyl bromide for a reaction again, and after the reaction is finished, carrying out separating to obtain 1,3-dipropargyl meta-carborane; and (2) under the catalytic condition of a catalyst CuI, carrying out a reaction on 1,3-dipropargyl meta-carborane and aryl azide, then adding PdCl2 into a reaction system, continuing the reaction, and after the reaction is finished, carrying out separation to obtain the palladium complex containing the meta-carborane triazole ligand. Compared with the prior art, the preparation method provided by the invention is simple and green; the complex can efficiently catalyze a coupling reaction of mercaptan and halogenated hydrocarbon to synthesize thioether compounds; reaction conditions are mild, substrate universality is good, catalytic efficiency is high, and few byproducts are produced;and the catalyst has high stability and is not sensitive to air and water.

A Robust Pd-Catalyzed C-S Cross-Coupling Process Enabled by Ball-Milling

An operationally simple mechanochemical C-S coupling of aryl halides with thiols has been developed. The reaction process operates under benchtop conditions without the requirement for a (dry) solvent, an inert atmosphere, or catalyst preactivation. The reaction is finished within 3 h. The reaction is demonstrated across a broad range of substrates; the inclusion of zinc metal has been found to be critical in some instances, especially for coupling of alkyl thiols.