2-(Trifluoroacetyl)cycloheptanone

Base Information

Chemical Name:2-(Trifluoroacetyl)cycloheptanone
CAS No.:82726-77-0
Molecular Formula:C9H11 F3 O2
Molecular Weight:208.18
Hs Code.:2914700090
DSSTox Substance ID:DTXSID70426031
Nikkaji Number:J882.531I
Mol file:82726-77-0.mol

Synonyms:2-(trifluoroacetyl)cycloheptanone;82726-77-0;2-(2,2,2-trifluoroacetyl)cycloheptan-1-one;2-(2,2,2-Trifluoroacetyl)cycloheptanone;MFCD07779556;trifluoroacetylcycloheptanone;SCHEMBL16935259;DTXSID70426031;WMDLGLZRZCXLSM-UHFFFAOYSA-N;BBL101602;STL555398;AKOS007929956;AM805965;CS-0364310

Suppliers and Price of 2-(Trifluoroacetyl)cycloheptanone

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

TRC
2-(Trifluoroacetyl)cycloheptanone
50mg
$ 90.00

Crysdot
2-(2,2,2-Trifluoroacetyl)cycloheptanone 95+%
1g
$ 625.00

American Custom Chemicals Corporation
2-(TRIFLUOROACETYL)CYCLOHEPTANONE 95.00%
10G
$ 1620.23

Total 6 raw suppliers

Chemical Property of 2-(Trifluoroacetyl)cycloheptanone

Chemical Property:

PSA：34.14000
LogP:2.26720
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:208.07111408
Heavy Atom Count:14
Complexity:245

Purity/Quality:

99%+ ^*data from raw suppliers

2-(Trifluoroacetyl)cycloheptanone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CCC(C(=O)CC1)C(=O)C(F)(F)F

Technology Process of 2-(Trifluoroacetyl)cycloheptanone

There total 2 articles about 2-(Trifluoroacetyl)cycloheptanone 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: 65.55%

: 82726-77-0
2-(2,2,2-trifluoroacetyl)cycloheptanone

Guidance literature:: With sodium hydride; In tetrahydrofuran; for 0.5h; Cooling with ice;

In tetrahydrofuran; at 20 ℃; for 12h; Cooling with ice;

Reference yield: 54.0%

: 383-63-1
ethyl trifluoroacetate,

: 502-42-1
cycloheptanone

: 82726-77-0
2-(2,2,2-trifluoroacetyl)cycloheptanone

Guidance literature:: ethyl trifluoroacetate,; cycloheptanone; With sodium methylate; In diethyl ether; at -10 - 20 ℃;

With acetic acid;
DOI:10.1021/ml400251g