ethyl 4-(benzylsulfanyl)benzoate

Base Information

• Chemical Name: ethyl 4-(benzylsulfanyl)benzoate
• CAS No.: 58324-80-4
• Molecular Formula: C16H16O2S
• Molecular Weight: 272.368
• Hs Code.: 2930909090
• Mol file: 58324-80-4.mol

Synonyms:Benzoic acid,p-benzylthio-,ethyl ester;4-benzylsulfanyl-benzoic acid ethyl ester;4-Benzylmercapto-benzoesaeure-aethylester;

Chemical Property of ethyl 4-(benzylsulfanyl)benzoate

Chemical Property:

• Vapor Pressure: 9.54E-07mmHg at 25°C
• Boiling Point: 404.3°Cat760mmHg
• Flash Point: 193.9°C
• PSA: 51.60000
• Density: 1.17g/cm³
• LogP: 4.15560

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of ethyl 4-(benzylsulfanyl)benzoate

There total 7 articles about ethyl 4-(benzylsulfanyl)benzoate 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: 72.0%

4-(pyrrolidin-1-ylazo)-benzoic acid ethyl ester (1425947-05-2) + benzyl chloride (100-44-7) → ethyl 4-(benzylthio)benzoate (58324-80-4)

Guidance literature:

benzyl chloride; With [2,2]bipyridinyl; copper(ll) sulfate pentahydrate; Sodium thiosulfate pentahydrate; In water; at 80 ℃; for 2h; Schlenk technique;

4-(pyrrolidin-1-ylazo)-benzoic acid ethyl ester; With boron trifluoride diethyl etherate; In water; at 20 ℃; for 12h; Schlenk technique;

DOI:10.1039/c4cc08367a

Reference yield: 57.0%

benzyl chloride (100-44-7) + p-aminoethylbenzoate (94-09-7) → ethyl 4-(benzylthio)benzoate (58324-80-4)

Guidance literature:

benzyl chloride; With [2,2]bipyridinyl; copper(ll) sulfate pentahydrate; sodium thiosulfate pentahydrate; In methanol; water; at 80 ℃; for 2h; Schlenk technique;

p-aminoethylbenzoate; With tert.-butylnitrite; In methanol; water; at 0 - 80 ℃; for 4.66667h; Schlenk technique;

DOI:10.1021/ol5009747

Reference yield: 57.0%

ethyl 4-chlorobenzoate (7335-27-5) + phenylmethanethiol (100-53-8) → ethyl 4-(benzylthio)benzoate (58324-80-4)

Guidance literature:

With phenylzinc chloride lithium chloride; trans-[4,5-bis(diphenylphosphino)-9,9-dimethylxanthene](2-methylphenyl)nickel(II) chloride; In tetrahydrofuran; 1-methyl-pyrrolidin-2-one; at 60 ℃; for 4h; Schlenk technique; Inert atmosphere;

DOI:10.1021/acs.orglett.8b03476

upstream raw materials:

ethanol

4-benzylsulfanylbenzoic acid

ethyl 4-nitrobenzoate

sodium benzylmercaptide

Refernces

• 1、 Zhang, Yonghong,Li, Yiming,Zhang, Xiaomei,Jiang, Xuefeng. "Sulfide synthesis through copper-catalyzed C-S bond formation under biomolecule-compatible conditions". supporting information. p. 941 - 944. Retrieved 2015/01/09.