Diphenylmethanethiol acetate

Base Information

• Chemical Name: Diphenylmethanethiol acetate
• CAS No.: 53392-47-5
• Molecular Formula: C15H14OS
• Molecular Weight: 242.342
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID70703314
• Mol file: 53392-47-5.mol

Synonyms:Diphenylmethanethiol acetate;53392-47-5;acetic acid;diphenylmethanethiol;SCHEMBL3416047;DTXSID70703314;Acetic acid--diphenylmethanethiol (1/1)

Chemical Property of Diphenylmethanethiol acetate

Chemical Property:

• Vapor Pressure: 5.2E-05mmHg at 25°C
• Melting Point: 56-59 °C(lit.)
• Refractive Index: 1.597
• Boiling Point: 348°C at 760 mmHg
• Flash Point: 147.6°C
• PSA: 42.37000
• Density: 1.134g/cm³
• LogP: 4.05570
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 260.08710092
• Heavy Atom Count: 18
• Complexity: 168

Purity/Quality:

99% ^*data from raw suppliers

Diphenylmethanethiol acetate 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)S

Technology Process of Diphenylmethanethiol acetate

There total 7 articles about Diphenylmethanethiol acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 91.0%

N-tosyldiphenylmethylamine (853-83-8) + tiolacetic acid (507-09-5) → diphenylmethyl thioacetate (53392-47-5)

Guidance literature:

With chloro-trimethyl-silane; zinc(II) chloride; In dichloromethane; at 20 ℃; for 0.5h;

DOI:10.1002/chem.200801665

Reference yield: 85.0%

1,1-Diphenylmethanol (91-01-0) + tiolacetic acid (507-09-5) → diphenylmethyl thioacetate (53392-47-5)

Guidance literature:

With tris(pentafluorophenyl)borate; In nitromethane; at 80 ℃; for 3h; chemoselective reaction; Inert atmosphere; Sealed tube;

DOI:10.1039/c4ob01265h

Reference yield: 76.0%

Bromodiphenylmethane (776-74-9) + potassium thioacetate (10387-40-3) → diphenylmethyl thioacetate (53392-47-5)

Guidance literature:

With silica gel; In benzene; at 20 ℃; for 1h;

DOI:10.1081/SCC-120025193

upstream raw materials:

diphenylchloromethane

tetra-n-butylammonium thioacetate

acetyl chloride

3,3,6,6-tetraphenyl-1,2,4,5-tetrathiane

Downstream raw materials:

diphenylmethanethiol

bis(diphenylmethyl)disulfide

(3R,5S,8R,9S,10S,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-3-((R)-diphenyl-methanesulfinyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene

(3R,5S,8R,9S,10S,13R,14S,17R)-3-Benzhydrylsulfanyl-17-((R)-1,5-dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene

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