S-(2-Methylpropyl) phenylcarbamothioate

Base Information

Chemical Name:S-(2-Methylpropyl) phenylcarbamothioate
CAS No.:56741-08-3
Molecular Formula:C11H15NOS
Molecular Weight:209.30800
Hs Code.:
DSSTox Substance ID:DTXSID80541163
Wikidata:Q82417423

Synonyms:56741-08-3;S-(2-Methylpropyl) phenylcarbamothioate;DTXSID80541163

Suppliers and Price of S-(2-Methylpropyl) phenylcarbamothioate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of S-(2-Methylpropyl) phenylcarbamothioate

Chemical Property:

PSA：57.89000
LogP:3.62130
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:209.08743528
Heavy Atom Count:14
Complexity:176

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)CSC(=O)NC1=CC=CC=C1

Technology Process of S-(2-Methylpropyl) phenylcarbamothioate

There total 3 articles about S-(2-Methylpropyl) phenylcarbamothioate 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: 73.0%

: 513-44-0
2-methylpropanethiol-1

: 21561-99-9
N-methyl-N'-phenyl-N-nitrosourea

: 56741-08-3
phenyl-thiocarbamic acid S-isobutyl ester

Guidance literature:: In acetonitrile; at 60 ℃; for 0.5h;
DOI:10.1246/bcsj.58.2143

Reference yield:

: 62-53-3
aniline

: 56741-08-3
phenyl-thiocarbamic acid S-isobutyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 2) NaNO₂,HCOOH / 2) 0-5 deg C, 1 h.

2: 73 percent / acetonitrile / 0.5 h / 60 °C

With formic acid; sodium nitrite; In acetonitrile;
DOI:10.1246/bcsj.58.2143