Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate

Base Information

Chemical Name:Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate
CAS No.:90136-87-1
Molecular Formula:C18H17NO3S
Molecular Weight:327.404
Hs Code.:
DSSTox Substance ID:DTXSID00522570

Synonyms:90136-87-1;Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate;DTXSID00522570

Suppliers and Price of Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate

Supply Marketing:

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

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Chemical Property of Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:327.09291458
Heavy Atom Count:23
Complexity:436

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1CC(=O)N1C2=CC=CC=C2C(=O)OCC3=CC=CC=C3

Technology Process of Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]benzoate

There total 5 articles about Benzyl 2-[2-(methylsulfanyl)-4-oxoazetidin-1-yl]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: 87.0%

: (3R,4S/3S,4R)-1-(2-Benzyloxycarbonylphenyl)-3-chlor-4-methylthio-2-azetidinon

: 90136-87-1
1-(2-Benzyloxycarbonylphenyl)-4-methylthio-2-azetidinon

Guidance literature:: With azobisisobutyronitrile; tri-n-butyl-tin hydride; In benzene; for 2h; Heating;
DOI:10.1007/BF00798412

Reference yield:

: 82185-41-9
benzyl anthranilate

: 90136-87-1
1-(2-Benzyloxycarbonylphenyl)-4-methylthio-2-azetidinon

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) POCl₃; 2.) 2 N NaOH / 1.) benzene, 16 h, RT; 2.) water

2: 68 percent / H₂S / dimethylformamide / 1.5 h / -5 °C

3: anhydrous K₂CO₃ / acetone / 20 h / 20 °C

4: 61 percent / NEt₃ / benzene / 5 h / Heating

5: 87 percent / Bu3SnH; α,α'-azoisobutyronitrile / benzene / 2 h / Heating

With sodium hydroxide; azobisisobutyronitrile; hydrogen sulfide; tri-n-butyl-tin hydride; potassium carbonate; triethylamine; trichlorophosphate; In N,N-dimethyl-formamide; acetone; benzene;
DOI:10.1007/BF00798412

Reference yield:

: 90136-84-8
N-Thioformylanthranilsaeurebenzylester

: 90136-87-1
1-(2-Benzyloxycarbonylphenyl)-4-methylthio-2-azetidinon

Guidance literature:: Multi-step reaction with 3 steps

1: anhydrous K₂CO₃ / acetone / 20 h / 20 °C

2: 61 percent / NEt₃ / benzene / 5 h / Heating

3: 87 percent / Bu3SnH; α,α'-azoisobutyronitrile / benzene / 2 h / Heating

With azobisisobutyronitrile; tri-n-butyl-tin hydride; potassium carbonate; triethylamine; In acetone; benzene;
DOI:10.1007/BF00798412