tert-Butyl ((2-oxooxazolidin-5-yl)methyl)carbamate

Base Information

• Chemical Name: tert-Butyl ((2-oxooxazolidin-5-yl)methyl)carbamate
• CAS No.: 212913-13-8
• Molecular Formula: C₉H₁₆N₂O₄
• Molecular Weight: 216.237
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID60572571
• Mol file: 212913-13-8.mol

Synonyms:212913-13-8;tert-Butyl ((2-oxooxazolidin-5-yl)methyl)carbamate;tert-Butyl N-[(2-oxo-1,3-oxazolan-5-yl)methyl]-carbamate;tert-butyl N-[(2-oxo-1,3-oxazolidin-5-yl)methyl]carbamate;Carbamic acid, [(2-oxo-5-oxazolidinyl)methyl]-, 1,1-dimethylethyl ester (9CI);TEMOCILLINSODIUM;tert-butyl N-[(2-oxo-1,3-oxazolan-5-yl)methyl]carbamate;SCHEMBL591272;DTXSID60572571;MFCD12827777;AKOS005072753;FD-0238;CS-0207923;EN300-1879336;A925195;tert-Butyl((2-oxooxazolidin-5-yl)methyl)carbamate;J-524327;tert-Butyl [(2-oxo-1,3-oxazolidin-5-yl)methyl]carbamate;Carbamic acid, [(2-oxo-5-oxazolidinyl)methyl]-, 1,1-dimethylethyl ester

Chemical Property of tert-Butyl ((2-oxooxazolidin-5-yl)methyl)carbamate

Chemical Property:

• PSA: 76.66000
• LogP: 1.33920
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 216.11100700
• Heavy Atom Count: 15
• Complexity: 259

Purity/Quality:

97% ^*data from raw suppliers

tert-Butyl N-[(2-oxo-1,3-oxazolan-5-yl)methyl]-carbamate >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCC1CNC(=O)O1

Technology Process of tert-Butyl ((2-oxooxazolidin-5-yl)methyl)carbamate

There total 4 articles about tert-Butyl ((2-oxooxazolidin-5-yl)methyl)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: 97.0%

(1'S,5S)-5-tert-butoxycarbonylaminomethyl-3-(1'-phenylethyl)-1,3-oxazolidin-2-one (917824-22-7) → tert-butyl N-{[(5R)-2-oxo-1,3-oxazolidin-5-yl]methyl}carbamate (212913-13-8)

Guidance literature:

With ammonia; lithium; In tetrahydrofuran; at -78 ℃; for 0.166667h;

DOI:10.1016/j.tetasy.2006.08.006

Reference yield: 89.0%

(3-tert-butoxycarbonylamino-2-hydroxy-propyl)-carbamic acid tert-butyl ester (98642-15-0) → 4-(N-tert-butyloxycarbonylaminomethyl)oxazolidin-2-one (212913-13-8)

Guidance literature:

With sodium hydride; In tetrahydrofuran; for 15h; Product distribution; Ambient temperature; in the presence of alkyl halides as well; other solvent;

Reference yield: 84.0%

(1'S,5R)-5-tert-butoxycarbonylaminomethyl-3-(1'-phenylethyl)-1,3-oxazolidin-2-one (917824-20-5) → (5S)-5-tert-butoxycarbonylaminomethyl-1,3-oxazolidin-2-one (274264-59-4,212913-13-8)

Guidance literature:

With ammonia; lithium; In tetrahydrofuran; at -78 ℃; for 0.166667h;

DOI:10.1016/j.tetasy.2006.08.006

upstream raw materials:

(3-tert-butoxycarbonylamino-2-hydroxy-propyl)-carbamic acid tert-butyl ester

(1'S,5R)-5-tert-butoxycarbonylaminomethyl-3-(1'-phenylethyl)-1,3-oxazolidin-2-one

(1'S,5S)-5-tert-butoxycarbonylaminomethyl-3-(1'-phenylethyl)-1,3-oxazolidin-2-one

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