2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one

Base Information

Chemical Name:2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one
CAS No.:158432-45-2
Molecular Formula:C9H11 F3 O2
Molecular Weight:208.18
Hs Code.:
DSSTox Substance ID:DTXSID10569754
Nikkaji Number:J1.208.833G
Wikidata:Q82456970
Mol file:158432-45-2.mol

Synonyms:158432-45-2;Ethanone, 2,2,2-trifluoro-1-(2-methoxy-1-cyclohexen-1-yl)- (9CI);2,2,2-trifluoro-1-(2-methoxycyclohexen-1-yl)ethanone;DTXSID10569754;2,2,2-trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethanone;2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one

Suppliers and Price of 2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one

Supply Marketing:

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one

Chemical Property:

PSA：26.30000
LogP:2.59230
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:208.07111408
Heavy Atom Count:14
Complexity:266

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(CCCC1)C(=O)C(F)(F)F

Technology Process of 2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one

There total 3 articles about 2,2,2-Trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethan-1-one 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: 68.0%

: 933-40-4
cycloxexanone dimethyl ketal

: 407-25-0
trifluoroacetic anhydride

: 158432-45-2
2,2,2-trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethanone

Guidance literature:: With pyridine; In chloroform; at 45 ℃; for 16h;
DOI:10.1080/00397910500278818

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 158432-45-2
2,2,2-trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethanone

Guidance literature:: Multi-step reaction with 2 steps

1: toluene-4-sulfonic acid / methanol

2: pyridine

With pyridine; toluene-4-sulfonic acid; In methanol;
DOI:10.1007/s00706-016-1829-0

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 158432-45-2
2,2,2-trifluoro-1-(2-methoxycyclohex-1-en-1-yl)ethanone

Guidance literature:: Multi-step reaction with 2 steps

1: TsOH / methanol / 24 h / 20 °C

2: 68 percent / pyridine / CHCl₃ / 16 h / 45 °C

With pyridine; toluene-4-sulfonic acid; In methanol; chloroform;
DOI:10.1080/00397910500278818