Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester

Base Information

Chemical Name:Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester
CAS No.:646522-80-7
Molecular Formula:C₁₄H₁₅F₃O₄S
Molecular Weight:336.332
Hs Code.:
DSSTox Substance ID:DTXSID30464212
Nikkaji Number:J1.993.339C
Wikidata:Q82289456

Synonyms:646522-80-7;Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester;DTXSID30464212

Suppliers and Price of Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester

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 2 raw suppliers

Chemical Property of Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:336.06431462
Heavy Atom Count:22
Complexity:479

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C=CCCCCC(=O)C1=CC=CC=C1OS(=O)(=O)C(F)(F)F

Technology Process of Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl ester

There total 4 articles about Methanesulfonic acid, trifluoro-, 2-(1-oxo-6-heptenyl)phenyl 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:

: 358-23-6
trifluoromethylsulfonic anhydride

: 526208-11-7
1-(2-hydroxy-phenyl)-hept-6-en-1-one

: 646522-80-7
trifluoromethanesulfonic acid 2-hept-6-enoylphenyl ester

Guidance literature:: With pyridine; In dichloromethane; at -78 - 20 ℃;
DOI:10.1021/jo0352023

Reference yield:

: 1119-60-4
hept-6-enoic acid

: 646522-80-7
trifluoromethanesulfonic acid 2-hept-6-enoylphenyl ester

Guidance literature:: Multi-step reaction with 4 steps

1.1: carbonyl diimidazole / CH₂Cl₂ / 0.75 h

1.2: CH₂Cl₂

2.1: n-BuLi / tetrahydrofuran; hexane / 0.17 h / -78 °C

2.2: tetrahydrofuran; hexane / -78 - 20 °C

3.1: BCl₃ / CH₂Cl₂ / -78 - 20 °C

4.1: pyridine / CH₂Cl₂ / -78 - 20 °C

With pyridine; n-butyllithium; boron trichloride; 1,1'-carbonyldiimidazole; In tetrahydrofuran; hexane; dichloromethane;
DOI:10.1021/jo0352023

Reference yield:

: 1000063-41-1
hept-6-enoic acid methoxy-methyl-amide

: 646522-80-7
trifluoromethanesulfonic acid 2-hept-6-enoylphenyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: n-BuLi / tetrahydrofuran; hexane / 0.17 h / -78 °C

1.2: tetrahydrofuran; hexane / -78 - 20 °C

2.1: BCl₃ / CH₂Cl₂ / -78 - 20 °C

3.1: pyridine / CH₂Cl₂ / -78 - 20 °C

With pyridine; n-butyllithium; boron trichloride; In tetrahydrofuran; hexane; dichloromethane;
DOI:10.1021/jo0352023