o-Mercapto-N,N-dimethylbenzamide

Base Information

Chemical Name:o-Mercapto-N,N-dimethylbenzamide
CAS No.:20877-02-5
Molecular Formula:C9H11NOS
Molecular Weight:181.258
Hs Code.:2930909090
European Community (EC) Number:244-094-3
UNII:J7U7CWS7NL
DSSTox Substance ID:DTXSID70174989
Nikkaji Number:J225.353D
Wikidata:Q83045190
Mol file:20877-02-5.mol

Synonyms:20877-02-5;n,n-dimethyl-2-sulfanylbenzamide;o-Mercapto-N,N-dimethylbenzamide;2-mercapto-n,n-dimethylbenzamide;Benzamide, 2-mercapto-N,N-dimethyl-;2-Mercapto-N,N-dimethyl-benzamide;EINECS 244-094-3;J7U7CWS7NL;N,N-dimethyl-2-thiobenzamide;SCHEMBL234114;DTXSID70174989;N,N-Dimethyl-2-mercaptobenzamide;AC9832;MFCD17015441;AKOS026737225;SY253093;A849728

Suppliers and Price of o-Mercapto-N,N-dimethylbenzamide

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

AK Scientific
o-Mercapto-N,N-dimethylbenzamide
5g
$ 1268.00

Total 7 raw suppliers

Chemical Property of o-Mercapto-N,N-dimethylbenzamide

Chemical Property:

Vapor Pressure:0.000242mmHg at 25°C
Boiling Point:324.7°Cat760mmHg
PKA:6.05±0.43(Predicted)
Flash Point:150.1°C
PSA：59.11000
Density:1.152g/cm³
LogP:1.67710
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:181.05613515
Heavy Atom Count:12
Complexity:170

Purity/Quality:

97% ^*data from raw suppliers

o-Mercapto-N,N-dimethylbenzamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C)C(=O)C1=CC=CC=C1S

Technology Process of o-Mercapto-N,N-dimethylbenzamide

There total 5 articles about o-Mercapto-N,N-dimethylbenzamide 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: 89.0%

: 1240-22-8
2-(dimethylcarbamoyl-phenyldisulfanyl)-M,N-dimethylbenzamide

: 20877-02-5
2-thio-N,N-dimethylbenzamide

Guidance literature:: With water; tris-(2-carboxyethyl)-phosphine hydrochloride; In methanol; at 20 ℃;

Reference yield:

: 119-80-2
2,2'-dithiobenzoic acid

: 20877-02-5
2-thio-N,N-dimethylbenzamide

Guidance literature:: Multi-step reaction with 3 steps

1: (COCl)2

3: NaBH₄

With sodium tetrahydroborate; oxalyl dichloride;
DOI:10.1021/jm970166j