2-Methoxy-1-methyl-2-oxoethyl butyrate

Base Information

• Chemical Name: 2-Methoxy-1-methyl-2-oxoethyl butyrate
• CAS No.: 96619-87-3
• Molecular Formula: C8H14 O4
• Molecular Weight: 174.197
• European Community (EC) Number: 306-199-3
• DSSTox Substance ID: DTXSID40914415
• Nikkaji Number: J382.897B
• Mol file: 96619-87-3.mol

Synonyms:96619-87-3;2-Methoxy-1-methyl-2-oxoethyl butyrate;EINECS 306-199-3;1-METHOXY-1-OXOPROPAN-2-YL BUTANOATE;SCHEMBL24220782;DTXSID40914415;YKJAHVZTCFGXAH-UHFFFAOYSA-N;NS00066231

Chemical Property of 2-Methoxy-1-methyl-2-oxoethyl butyrate

Chemical Property:

• Vapor Pressure: 0.153mmHg at 25°C
• Boiling Point: 214.7°C at 760 mmHg
• Flash Point: 97.3°C
• PSA: 52.60000
• Density: 1.037g/cm³
• LogP: 0.89120
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 174.08920892
• Heavy Atom Count: 12
• Complexity: 164

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC(C)C(=O)OC

Technology Process of 2-Methoxy-1-methyl-2-oxoethyl butyrate

There total 2 articles about 2-Methoxy-1-methyl-2-oxoethyl butyrate 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:

methyl lactate (547-64-8,2155-30-8) + butyric acid (107-92-6) → methyl 2-butyroxypropionate (96619-87-3) + 2-butyryloxy-propionic acid (84681-86-7)

Guidance literature:

With sulfuric acid; benzene; und Entfernen des entstehenden Wassers;

Reference yield:

methanol (67-56-1) + vinyl n-butyrate (123-20-6,24991-31-9) + carbon monoxide (201230-82-2) → methyl 2-butyroxypropionate (96619-87-3)

Guidance literature:

With 2,6-dimethylpyridine; bis-triphenylphosphine-palladium(II) chloride; In benzene; at 100 ℃; for 5h; under 114000 Torr;

DOI:10.1246/bcsj.69.1337

upstream raw materials:

methyl lactate

butyric acid

methanol

vinyl n-butyrate

Refernces