2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate

Base Information

• Chemical Name: 2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate
• CAS No.: 116943-54-5
• Molecular Formula: C11H15 Cl N2 O4 S
• Molecular Weight: 306.7658
• DSSTox Substance ID: DTXSID00922213

Synonyms:BRN 5593493;2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate;116943-54-5;Carbamic acid, (((1-phenylethyl)amino)sulfonyl)-, 2-chloroethyl ester;N-(Chloro-2 ethoxycarbonyl) N'-(alpha-phenyl ethyl) sulfamide [French];N-(Chloro-2 ethoxycarbonyl) N'-(alpha-phenyl ethyl) sulfamide;DTXSID00922213;LS-50545;2-Chloroethyl hydrogen [(1-phenylethyl)sulfamoyl]carbonimidate

Chemical Property of 2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.357g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 306.0441058
• Heavy Atom Count: 19
• Complexity: 377

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=CC=C1)NS(=O)(=O)NC(=O)OCCCl

Technology Process of 2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate

There total 1 articles about 2-Chloroethyl (((1-phenylethyl)amino)sulfonyl)carbamate 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: 49.0%

2-chloroethyl chlorosulfonylcarbamate (87708-19-8) + rac-methylbenzylamine (618-36-0) → N-(chloro-2 ethoxycarbonyl) N'-(α-phenyl ethyl) sulfamide (116943-54-5)

Guidance literature:

With triethylamine; In benzene; for 15h;

Reference yield: 91.0%

N-(chloro-2 ethoxycarbonyl) N'-(α-phenyl ethyl) sulfamide (116943-54-5) → N-(N'-(α-phenyl-ethyl) sulfamyl) oxazolidinone-2 (116943-63-6)

Guidance literature:

With triethylamine; In dichloromethane; for 15h;

Reference yield: 91.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + N-(chloro-2 ethoxycarbonyl) N'-(α-phenyl ethyl) sulfamide (116943-54-5) → N-methyl N-(chloro-2 ethoxycarbonyl) N'-methyl N'-(phenyl ethyl) sulfamide (116943-73-8)

Guidance literature:

In diethyl ether; dichloromethane;

upstream raw materials:

2-chloroethyl chlorosulfonylcarbamate

rac-methylbenzylamine

Downstream raw materials:

N-methyl N-(chloro-2 ethoxycarbonyl) N'-methyl N'-(phenyl ethyl) sulfamide

N-(N'-(α-phenyl-ethyl) sulfamyl) oxazolidinone-2

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