2-oxoethyl N,N-dimethylcarbamate

Base Information

• Chemical Name: 2-oxoethyl N,N-dimethylcarbamate
• CAS No.: 133731-62-1
• Molecular Formula: C₅H₉NO₃
• Molecular Weight: 131.131
• DSSTox Substance ID: DTXSID601266714
• Mol file: 133731-62-1.mol

Synonyms:2-oxoethyl N,N-dimethylcarbamate;133731-62-1;Carbamic acid, dimethyl-, 2-oxoethyl ester (9CI);SCHEMBL8943542;DTXSID601266714;Carbamic acid, dimethyl-, 2-oxoethyl ester

Chemical Property of 2-oxoethyl N,N-dimethylcarbamate

Chemical Property:

• PSA: 46.61000
• LogP: -0.11650
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 131.058243149
• Heavy Atom Count: 9
• Complexity: 111

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C)C(=O)OCC=O

Technology Process of 2-oxoethyl N,N-dimethylcarbamate

There total 1 articles about 2-oxoethyl N,N-dimethylcarbamate 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:

1,4-bis-cis-2-butene (31062-88-1) → N,N-dimethylcarbamoyloxyacetaldehyde (133731-62-1)

Guidance literature:

With dimethylsulfide; ozone; Yield given. Multistep reaction; 1.) MeOH, -78 deg C, 30 min, 2.) MeOH, r.t., 1 h;

DOI:10.7164/antibiotics.47.1526

Reference yield:

1-Phenyl-2-propen-1-ol (4393-06-0) + N,N-dimethylcarbamoyloxyacetaldehyde (133731-62-1) → C14H17NO3

Guidance literature:

With dichloro-acetic acid; bis(1,5-cyclooctadiene)diiridium(I) dichloride; (R)-(-)-α,α-bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanoltrimethylsilyl ether; C₃₅H₂₃O₂P; In 1,2-dichloro-ethane; at 20 ℃; diastereoselective reaction; Inert atmosphere;

DOI:10.1002/anie.201506933

Reference yield:

1-Phenyl-2-propen-1-ol (4393-06-0) + N,N-dimethylcarbamoyloxyacetaldehyde (133731-62-1) → C14H17NO3 + C14H17NO3

Guidance literature:

With (S)-2-{bis[3,5-bis(trifluoromethyl)phenyl][(trimethylsilanyl)oxy]methyl}pyrrolidine; dichloro-acetic acid; bis(1,5-cyclooctadiene)diiridium(I) dichloride; C₃₅H₂₃O₂P; In 1,2-dichloro-ethane; at 20 ℃; diastereoselective reaction; Inert atmosphere;

DOI:10.1002/anie.201506933

upstream raw materials:

1,4-bis-cis-2-butene

Downstream raw materials:

4-methoxyphenylmethyl 7-<(Z)-2-(2-tritylaminothiazol-4-yl)-2-methoxyiminoacetamido>-3-<(Z)-3-(N,N-dimethylcarbamoyloxy)-1-propenyl>-3-cephem-4-carboxylate

4-methoxyphenylmethyl 7-<(Z)-2-(2-tritylaminothiazol-4-yl)-2-trityloxyiminoacetamido>-3-<(Z)-3-(N,N-dimethylcarbamoyloxy)-1-propenyl>-3-cephem-4-carboxylate

Refernces