Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate

Base Information

Chemical Name:Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate
CAS No.:26759-41-1
Molecular Formula:C11H12 O6 S
Molecular Weight:272.279
Hs Code.:2918990090
European Community (EC) Number:247-965-6
UNII:PC7K8DT7FS
DSSTox Substance ID:DTXSID00181267
Nikkaji Number:J249.030G
Wikidata:Q83051876
Mol file:26759-41-1.mol

Synonyms:26759-41-1;Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate;PC7K8DT7FS;EINECS 247-965-6;methyl 2-((2-methoxy-2-oxoethyl)sulfonyl)benzoate;methyl 2-[(2-methoxy-2-oxoethyl)sulphonyl]benzoate;METHYL 2-[(2-METHOXY-2-OXOETHYL)SULFONYL]BENZOATE;UNII-PC7K8DT7FS;methyl 2-(2-methoxy-2-oxoethyl)sulfonylbenzoate;SCHEMBL11794849;DTXSID00181267;METHYL 2-(2-METHOXY-2-OXOETHYL)SULPHONYLBENZOATE;2-[(2-Methoxy-2-oxoethyl)sulfonyl]benzoic acid methyl ester;BENZOIC ACID, 2-((2-METHOXY-2-OXOETHYL)SULFONYL)-, METHYL ESTER;BENZOIC ACID, 2-((2-METHOXY-2-OXOETHYL)SULPHONYL)-, METHYL ESTER

Suppliers and Price of Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate

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 7 raw suppliers

Chemical Property of Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate

Chemical Property:

Vapor Pressure:2.14E-08mmHg at 25°C
Boiling Point:453°Cat760mmHg
Flash Point:227.8°C
PSA：95.12000
Density:1.324g/cm³
LogP:1.50070
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:272.03545927
Heavy Atom Count:18
Complexity:408

Purity/Quality:: 98%Min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CS(=O)(=O)C1=CC=CC=C1C(=O)OC

Technology Process of Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate

There total 7 articles about Methyl 2-((2-methoxy-2-oxoethyl)sulphonyl)benzoate 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: 80.0%

: 67-56-1
methanol

: 1209-81-0
2-carboxymethanesulfonyl-benzoic acid

: 26759-41-1
methyl <(2-methoxycarbonyl)phenthio>acetate

Guidance literature:: With sodium carbonate; In sulfuric acid; water;

Reference yield: 74.0%

: 6287-88-3
methyl 2-[(2-methoxy-2-oxoethyl)thio]benzoate

: 26759-41-1
methyl <(2-methoxycarbonyl)phenthio>acetate

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 5 - 45 ℃;
DOI:10.1016/S0040-4020(02)00399-X

Reference yield:

: 100-68-5
methyl-phenyl-thioether

: 26759-41-1
methyl <(2-methoxycarbonyl)phenthio>acetate

Guidance literature:: Multi-step reaction with 2 steps

1.1: TMEDA; BuLi / hexane / 1.25 h / 40 - 58 °C

1.2: 71 percent / hexane; diethyl ether / 2 h / -80 °C

2.1: 74 percent / 3-chloroperbenzoic acid / CH₂Cl₂ / 5 - 45 °C

With n-butyllithium; N,N,N,N,-tetramethylethylenediamine; 3-chloro-benzenecarboperoxoic acid; In hexane; dichloromethane;
DOI:10.1016/S0040-4020(02)00399-X