3-(Benzylthio)propionic acid methyl ester

Base Information

• Chemical Name: 3-(Benzylthio)propionic acid methyl ester
• CAS No.: 5331-36-2
• Molecular Formula: C11H14O2S
• Molecular Weight: 210.297
• Hs Code.: 2930909090
• Mol file: 5331-36-2.mol

Synonyms:methyl 3-(benzylthio)propanoate;benzyl 2-methoxycarbonylethyl sulphide;Methyl 3-(benzylthio)propionate;METHYL-3-PROPIONATE;3-benzylsulfanyl-propionic acid methyl ester;methyl 3-<(phenylmethyl)thio>propanoate;methyl 3-(benzylsulfanyl)propanoate;3-Benzylmercapto-propionsaeure-methylester;methyl 3-benzylsulfanyl-propionate;

Chemical Property of 3-(Benzylthio)propionic acid methyl ester

Chemical Property:

• Vapor Pressure: 0.000676mmHg at 25°C
• Boiling Point: 308.6°C at 760 mmHg
• Flash Point: 140.7°C
• PSA: 51.60000
• Density: 1.111g/cm³
• LogP: 2.48290

Purity/Quality:

99% ^*data from raw suppliers

METHYL 3-(BENZYLTHIO)PROPIONATE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-(Benzylthio)propionic acid methyl ester

There total 11 articles about 3-(Benzylthio)propionic acid methyl ester 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%

benzyl chloride (100-44-7) + acrylic acid methyl ester (292638-85-8,9003-21-8,96-33-3) → methyl 3-(benzylthio)propanoate (5331-36-2)

Guidance literature:

benzyl chloride; With urea/choline chloride eutectic salt; thiourea; at 60 ℃; Green chemistry;

acrylic acid methyl ester; With sodium hydroxide; In water; for 1.33333h; Temperature; Reagent/catalyst; Heating; Green chemistry;

DOI:10.1016/j.tetlet.2014.01.104

Reference yield: 93.0%

S-benzylisothiourea hydrochloride (538-28-3,860511-29-1) + acrylic acid methyl ester (292638-85-8,9003-21-8,96-33-3) → methyl 3-(benzylthio)propanoate (5331-36-2)

Guidance literature:

With sodium hydroxide; In water; at 20 ℃; for 0.25h;

DOI:10.1055/s-2007-982530

Reference yield: 83.0%

Methyl 3-mercaptopropionate (2935-90-2) + benzyl alcohol (100-51-6,185532-71-2) → benzyl 3-(benzylthio)propanoate (1031756-23-6) + methyl 3-(benzylthio)propanoate (5331-36-2)

Guidance literature:

With nanolayered cobalt-molybdenum sulphide with Co/(Mo+Co) mole ratio 0.83; In Hexadecane; toluene; at 180 ℃; for 18h; under 2625.26 Torr; chemoselective reaction; Inert atmosphere; Autoclave;

DOI:10.1039/c8sc05782f

upstream raw materials:

Methyl 2,3-dibromopropionate

phenylmethanethiol

diazomethane

5-(benzylthio)pentanoic acid

Downstream raw materials:

3-phenylmethanesulfonyl-propionic acid methyl ester

4-benzylsulfanyl-2-methyl-butan-2-ol

3-(benzylthio)propanoic acid

benzyl 2-methoxycarbonylethyl sulphoxide

Refernces

• 1、 Azizi, Najmedin,Yadollahy, Zahra,Rahimzadeh-Oskooee, Amin. "An atom-economic and odorless thia-Michael addition in a deep eutectic solvent". . p. 1722 - 1725. Retrieved 2014/03/21.
• 2、 Ranu, Brindaban C.,Mandal, Tanmay. "Efficient synthesis of β-alkyl/arylsulfanyl carbonyl compounds by In-TMSCl-promoted cleavage of dialkyl/diaryl disulfides and subsequent Michael addition". . p. 1517 - 1523. Retrieved 2008/02/03.