4-(Hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one

Base Information

• Chemical Name: 4-(Hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one
• CAS No.: 6629-85-2
• Molecular Formula: C5H9 N O3
• Molecular Weight: 131.1299
• NSC Number: 57599
• DSSTox Substance ID: DTXSID00288785
• Nikkaji Number: J1.018.222K

Synonyms:6629-85-2;4-(hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one;4-(Hydroxymethyl)-4-methyloxazolidin-2-one;NSC57599;SCHEMBL1439232;DTXSID00288785;JKUDHKGYEHJGQR-UHFFFAOYSA-N;MFCD00034725;NSC-57599;AKOS024432072;AT13637;4-hydroxymethyl-4-methyloxazolidin-2-one;4-(Hydroxymethyl)-4-methyl-2-oxazolidone;CS-0210205;4-(hydroxymethyl)-4-methyl-oxazolidin-2-one;EN300-315459;Z1255419299

Chemical Property of 4-(Hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one

Chemical Property:

• Vapor Pressure: 3.47E-07mmHg at 25°C
• Boiling Point: 375.8°Cat760mmHg
• Flash Point: 181.1°C
• Density: 1.199g/cm³
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 131.058243149
• Heavy Atom Count: 9
• Complexity: 136

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(COC(=O)N1)CO

Technology Process of 4-(Hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one

There total 7 articles about 4-(Hydroxymethyl)-4-methyl-1,3-oxazolidin-2-one 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: 99.7%

2-Amino-2-methylpropane-1,3-diol (115-69-5) + 1,1'-carbonyldiimidazole (530-62-1) → 4-(hydroxymethyl)-4-methyloxazolidin-2-one (6629-85-2)

Guidance literature:

In tetrahydrofuran; at 0 - 20 ℃;

DOI:10.1021/ma0489218

Reference yield: 81.0%

hexaethyl 1,1,1,10,10,10-decanehexacarboxylate (106731-61-7) + 2-Amino-2-methylpropane-1,3-diol (115-69-5) → 4-(hydroxymethyl)-4-methyloxazolidin-2-one (6629-85-2) + N,N',N'',N'''-tetrakis<1,1-bis(hydroxymethyl)ethyl>-1,1,10,10-decanetetracarboxamide (130148-29-7)

Guidance literature:

With potassium carbonate; In dimethyl sulfoxide; at 25 ℃; for 15h;

Reference yield: 70.0%

2-Amino-2-methylpropane-1,3-diol (115-69-5) + Diethyl carbonate (105-58-8,76619-83-5) → 4-(hydroxymethyl)-4-methyloxazolidin-2-one (6629-85-2)

Guidance literature:

With sodium methylate; In ethanol; at 109.85 ℃; for 48h;

DOI:10.1107/S0108270198005654

upstream raw materials:

2-Amino-2-methylpropane-1,3-diol

Diethyl carbonate

hexaethyl 1,1,1,10,10,10-decanehexacarboxylate

methyl iodide

Downstream raw materials:

4-(chloromethyl)-4-methyloxazolidin-2-one

4-(((tert-butyldiphenylsilanyl)oxy)methyl)-4-methyloxazolidin-2-one

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