Butyl (methylthio)acetate

Base Information

Chemical Name:Butyl (methylthio)acetate
CAS No.:67746-25-2
Molecular Formula:C7H14O2S
Molecular Weight:162.253
Hs Code.:
European Community (EC) Number:266-987-7
UNII:QN58WY5942
DSSTox Substance ID:DTXSID5070577
Nikkaji Number:J333.331K
Wikidata:Q81997930
Mol file:67746-25-2.mol

Synonyms:Butyl (methylthio)acetate;n-Butyl 2-methylthioacetate;Acetic acid, (methylthio)-, butyl ester;67746-25-2;Acetic acid, 2-(methylthio)-, butyl ester;(Methylthio)acetic acid butyl ester;EINECS 266-987-7;Butyl 2-(methylthio)acetate;butyl (methylsulfanyl)acetate;DTXSID5070577;SCHEMBL12056720;CHEBI:156077;QN58WY5942;AKOS009165286;BUTYL 2-(METHYLSULFANYL)ACETATE

Suppliers and Price of Butyl (methylthio)acetate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of Butyl (methylthio)acetate

Chemical Property:

Vapor Pressure:0.268mmHg at 25°C
Refractive Index:1.46
Boiling Point:204.1°Cat760mmHg
Flash Point:79.1°C
PSA：51.60000
Density:1.004g/cm³
LogP:1.69270
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:162.07145086
Heavy Atom Count:10
Complexity:93.6

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCOC(=O)CSC

Technology Process of Butyl (methylthio)acetate

There total 2 articles about Butyl (methylthio)acetate 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:

: 63521-90-4
α-(methylthio)acetic acid anhydride

: 71-36-3
butan-1-ol

: 67746-25-2
butyl 2-(methylsulfanyl)acetate

Guidance literature:: With toluene-4-sulfonic acid; In diethyl ether; for 120h;
DOI:10.1016/j.phytochem.2010.01.016

Reference yield:

: 67746-25-2
butyl 2-(methylsulfanyl)acetate

Guidance literature:

Reference yield:

: 67746-25-2
butyl 2-(methylsulfanyl)acetate

: 100-52-7
benzaldehyde

: 131491-15-1,131491-16-2
butyl 2-(methylthio)-3-hydroxy-3-phenylpropionate

: 131491-15-1,131491-16-2
butyl 2-(methylthio)-3-hydroxy-3-phenylpropionate

Guidance literature:: With lithium diisopropyl amide; Yield given. Multistep reaction. Yields of byproduct given; 1) THF, -78 deg C, 2 h, 2) THF, -78 deg C, 1h;
DOI:10.1021/jo00002a054