Methyl 3,3-dimethyloxirane-2-carboxylate

Base Information

• Chemical Name: Methyl 3,3-dimethyloxirane-2-carboxylate
• CAS No.: 5584-70-3
• Molecular Formula: C6H10 O3
• Molecular Weight: 130.144
• DSSTox Substance ID: DTXSID00971241
• Mol file: 5584-70-3.mol

Synonyms:methyl 3,3-dimethyloxirane-2-carboxylate;5584-70-3;Methyl 3,3-dimethylglycidate;Oxiranecarboxylic acid, 3,3-dimethyl-, methyl ester;SCHEMBL903246;DTXSID00971241;Oxiranecarboxylic acid, 3,3-dimethyl-, methyl ester (9CI);AKOS013568794;methyl3,3-dimethyloxirane-2-carboxylate;EN300-699546;3,3-Dimethyloxirane-2-carboxylic acid, methyl ester;Z1216813947

Chemical Property of Methyl 3,3-dimethyloxirane-2-carboxylate

Chemical Property:

• Vapor Pressure: 13.8mmHg at 25°C
• Boiling Point: 122.6°Cat760mmHg
• Flash Point: 38.1°C
• PSA: 38.83000
• Density: 1.081g/cm³
• LogP: 0.33680
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 130.062994177
• Heavy Atom Count: 9
• Complexity: 139

Purity/Quality:

3,3-DIMETHYL-OXIRANECARBOXYLIC ACID METHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(O1)C(=O)OC)C

Technology Process of Methyl 3,3-dimethyloxirane-2-carboxylate

There total 6 articles about Methyl 3,3-dimethyloxirane-2-carboxylate 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: 55.0%

methyl chloroacetate (96-34-4) + acetone (67-64-1) → methyl 2,3-epoxy-3-methylbutyrate (5584-70-3) + tert-butyl 3,3-dimethyl-oxirane-2-carboxylate (856680-34-7)

Guidance literature:

With potassium tert-butylate; In diethyl ether; for 20h; Ambient temperature;

DOI:10.1002/recl.19921110101

Reference yield: 55.0%

potassium tert-butylate (865-47-4) + methyl chloroacetate (96-34-4) + acetone (67-64-1) → methyl 2,3-epoxy-3-methylbutyrate (5584-70-3) + tert-butyl 3,3-dimethyl-oxirane-2-carboxylate (856680-34-7)

Guidance literature:

In diethyl ether; for 20h; Ambient temperature;

DOI:10.1002/recl.19921110101

Reference yield: 44.0%

methyl chloroacetate (96-34-4) + acetone (67-64-1) → methyl 2,3-epoxy-3-methylbutyrate (5584-70-3)

Guidance literature:

With sodium methylate; In diethyl ether; at 5 - 20 ℃;

DOI:10.1021/jf0107196

upstream raw materials:

methyl chloroacetate

acetone

methyl 2-methyloxiranylacetate

potassium tert-butylate

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