Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid

Base Information

Chemical Name:Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid
CAS No.:56624-44-3
Molecular Formula:C12H15NO2S2
Molecular Weight:269.389
Hs Code.:
NSC Number:348090
DSSTox Substance ID:DTXSID50205200

Synonyms:56624-44-3;BRN 2744723;Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid;beta-(Benzylamino-thiocarbonyl-mercapto)-propionsaeure methylaester [German];Propanoic acid, 3-((((phenylmethyl)amino)thioxomethyl)thio)-, methyl ester;beta-(Benzylamino-thiocarbonyl-mercapto)-propionsaeure methylaester;DTXSID50205200;NSC348090;NSC 348090;NSC-348090;LS-124732

Suppliers and Price of Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid

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

Total 5 raw suppliers

Chemical Property of Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid

Chemical Property:

Vapor Pressure:1.53E-06mmHg at 25°C
Boiling Point:397.9°Cat760mmHg
Flash Point:194.5°C
Density:1.227g/cm³
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:269.05442107
Heavy Atom Count:17
Complexity:253

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CCSC(=S)NCC1=CC=CC=C1

Technology Process of Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid

There total 5 articles about Propionic acid, 3-mercapto-, methyl ester, ester with benzyldithiocarbamic acid 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: 95.0%

: 75-15-0,12122-00-8
carbon disulfide

: 292638-85-8,9003-21-8,96-33-3
acrylic acid methyl ester

: 100-46-9
benzylamine

: 56624-44-3
3-benzylthiocarbamoylsulfanyl-propionic acid methyl ester

Guidance literature:: With 1-pentyl-3-methylimidazolium bromide; at 28 - 30 ℃; for 0.166667h;
DOI:10.1002/ejoc.200700842

Reference yield:

: C₈H₈NS₂^(1-)

: 292638-85-8,9003-21-8,96-33-3
acrylic acid methyl ester

: 56624-44-3
3-benzylthiocarbamoylsulfanyl-propionic acid methyl ester

Guidance literature:: With N-benzyl-trimethylammonium hydroxide; In dimethyl sulfoxide; at 20 ℃; for 2.5h; Inert atmosphere;

Reference yield:

: 100-46-9
benzylamine

: 56624-44-3
3-benzylthiocarbamoylsulfanyl-propionic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: N-benzyl-trimethylammonium hydroxide / dimethyl sulfoxide / 0.5 h / 20 °C / Inert atmosphere

2: N-benzyl-trimethylammonium hydroxide / dimethyl sulfoxide / 2.5 h / 20 °C / Inert atmosphere

With N-benzyl-trimethylammonium hydroxide; In dimethyl sulfoxide; 2: |Michael Addition;