Benzyl 2-(4-oxoazetidin-2-yl)sulfanylbenzoate

Base Information

Chemical Name:Benzyl 2-(4-oxoazetidin-2-yl)sulfanylbenzoate
CAS No.:98369-49-4
Molecular Formula:C₁₇H₁₅NO₃S
Molecular Weight:313.377
Hs Code.:
DSSTox Substance ID:DTXSID20874902
Nikkaji Number:J1.545.791K

Synonyms:98369-49-4;DTXSID20874902;BENZOIC ACID, 2-[(4-OXO-2-AZETIDINYL)THIO]-, PHE

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

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Chemical Property of Benzyl 2-(4-oxoazetidin-2-yl)sulfanylbenzoate

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:313.07726451
Heavy Atom Count:22
Complexity:409

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(NC1=O)SC2=CC=CC=C2C(=O)OCC3=CC=CC=C3

Technology Process of Benzyl 2-(4-oxoazetidin-2-yl)sulfanylbenzoate

There total 4 articles about Benzyl 2-(4-oxoazetidin-2-yl)sulfanylbenzoate 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: 47.0%

: 28562-53-0
4-acetoxy azetidinone

: 75406-31-4
benzyl 2-mercaptobenzoate

: 98369-49-4
4-(2-benzyloxycarbonylphenylthio)azetidin-2-one

Guidance literature:: With sodium hydroxide; In 1,4-dioxane; water; for 2h; Ambient temperature;

Reference yield:

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

: 98369-49-4
4-(2-benzyloxycarbonylphenylthio)azetidin-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) 80percent NaH / 1.) DMF, paraffin oil, 0.5 h, 2.) 80-90 deg C, 1 h

2: 65 percent / PPh₃, conc. HCl / dioxane; H₂O / 4 h / 60 °C

3: 47 percent / NaOH / dioxane; H₂O / 2 h / Ambient temperature

With hydrogenchloride; sodium hydroxide; sodium hydride; triphenylphosphine; In 1,4-dioxane; water;

Reference yield:

: 100-39-0
benzyl bromide

: 98369-49-4
4-(2-benzyloxycarbonylphenylthio)azetidin-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) 80percent NaH / 1.) DMF, paraffin oil, 0.5 h, 2.) 80-90 deg C, 1 h

2: 65 percent / PPh₃, conc. HCl / dioxane; H₂O / 4 h / 60 °C

3: 47 percent / NaOH / dioxane; H₂O / 2 h / Ambient temperature

With hydrogenchloride; sodium hydroxide; sodium hydride; triphenylphosphine; In 1,4-dioxane; water;