Butoxyacetic acid ethyl ester

Base Information

• Chemical Name: Butoxyacetic acid ethyl ester
• CAS No.: 14144-70-8
• Molecular Formula: C8H16O3
• Molecular Weight: 160.213
• DSSTox Substance ID: DTXSID80560076
• Nikkaji Number: J191.524J
• Wikidata: Q82443054
• Mol file: 14144-70-8.mol

Synonyms:Butoxyacetic acid ethyl ester;ethyl butoxyacetate;Ethyl 2-butoxyacetate;14144-70-8;SCHEMBL546058;DTXSID80560076;SVBSJWKYFYUHTF-UHFFFAOYSA-N

Chemical Property of Butoxyacetic acid ethyl ester

Chemical Property:

• Vapor Pressure: 0.196mmHg at 25°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 160.109944368
• Heavy Atom Count: 11
• Complexity: 102

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOCC(=O)OCC

Technology Process of Butoxyacetic acid ethyl ester

There total 4 articles about Butoxyacetic acid ethyl ester 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: 88.0%

diazoacetic acid ethyl ester (623-73-4) + butan-1-ol (71-36-3) → n-BuOC(H)HCO2Et (14144-70-8)

Guidance literature:

methyltrioxorhenium(VII); In benzene; for 48h; Ambient temperature;

DOI:10.1021/ja954039t

Reference yield:

ethanol (64-17-5) + 2-butoxyacetic acid (2516-93-0) → n-BuOC(H)HCO2Et (14144-70-8)

Guidance literature:

With hydrogenchloride;

Reference yield:

diazoacetic acid ethyl ester (623-73-4) + dibutyl ether (142-96-1) → n-BuOC(H)HCO2Et (14144-70-8) + 5-butoxy-3-methyl-valeric acid ethyl ester (100386-23-0)

Guidance literature:

at 150 ℃;

upstream raw materials:

ethanol

2-butoxyacetic acid

diazoacetic acid ethyl ester

butan-1-ol

Downstream raw materials:

1-butoxy-2-methyl-propan-2-ol