2-(Benzyloxycarbonylamino)ethyl methanesulfonate

Base Information

• Chemical Name: 2-(Benzyloxycarbonylamino)ethyl methanesulfonate
• CAS No.: 134307-72-5
• Molecular Formula: C11H15NO5S
• Molecular Weight: 273.31
• DSSTox Substance ID: DTXSID80442202
• Nikkaji Number: J2.284.917D
• Wikidata: Q82259349
• Mol file: 134307-72-5.mol

Synonyms:134307-72-5;2-(benzyloxycarbonylamino)ethyl methanesulfonate;2-{[(Benzyloxy)carbonyl]amino}ethyl methanesulfonate;Carbamic acid, [2-[(methylsulfonyl)oxy]ethyl]-, phenylmethyl ester;2-(phenylmethoxycarbonylamino)ethyl methanesulfonate;SCHEMBL3524616;DTXSID80442202;XPBHPXODAUHISM-UHFFFAOYSA-N;FT-0710136;N-(2-Methylsulfonyloxyethyl)carbamic acid benzyl ester;methanesulfonic acid 2-benzyloxycarbonylamino-ethyl ester

Chemical Property of 2-(Benzyloxycarbonylamino)ethyl methanesulfonate

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 273.06709375
• Heavy Atom Count: 18
• Complexity: 343

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)OCCNC(=O)OCC1=CC=CC=C1

Technology Process of 2-(Benzyloxycarbonylamino)ethyl methanesulfonate

There total 5 articles about 2-(Benzyloxycarbonylamino)ethyl methanesulfonate 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: 100.0%

benzyl 2-hydroxyethylcarbamate (77987-49-6) + methanesulfonyl chloride (124-63-0) → 2-(((benzyloxy)carbonyl)amino)ethyl 1-methanesulfonate (134307-72-5)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

Reference yield: 100.0%

ethanolamine (141-43-5) + methanesulfonyl chloride (124-63-0) + benzyl chloroformate (501-53-1,94274-21-2) → 2-(((benzyloxy)carbonyl)amino)ethyl 1-methanesulfonate (134307-72-5)

Guidance literature:

ethanolamine; benzyl chloroformate; In dichloromethane; for 10h;

methanesulfonyl chloride; With triethylamine; In dichloromethane; at 0 - 20 ℃; for 0.25h;

Reference yield:

benzyl 2-hydroxyethylcarbamate (77987-49-6) → 2-(((benzyloxy)carbonyl)amino)ethyl 1-methanesulfonate (134307-72-5)

Guidance literature:

upstream raw materials:

benzyl 2-hydroxyethylcarbamate

methanesulfonyl chloride

benzyl chloroformate

ethanolamine

Downstream raw materials:

<1-¹³C>-3-Benzyloxycarbonylaminopropionitrile

benzyl N-(2-bromoethyl)carbamate