1-(Bromodifluoromethyl)cyclohex-1-ene

Base Information

Chemical Name:1-(Bromodifluoromethyl)cyclohex-1-ene
CAS No.:117711-60-1
Molecular Formula:C7H9 Br F2
Molecular Weight:211.049
Hs Code.:2903890090
DSSTox Substance ID:DTXSID60371248
Nikkaji Number:J607.910E
Wikidata:Q82158530
Mol file:117711-60-1.mol

Synonyms:117711-60-1;1-(Bromodifluoromethyl)cyclohex-1-ene;1-(Bromodifluoromethyl)cyclohexene;1-[bromo(difluoro)methyl]cyclohexene;Cyclohexene, 1-(bromodifluoromethyl)-;DTXSID60371248;1-Bromodifluoromethyl-1-cyclohexene;MFCD00153695;4-(chlorophenylmethyl)-1,1-biphenyl;AKOS015833929;FT-0605813;A803816

Suppliers and Price of 1-(Bromodifluoromethyl)cyclohex-1-ene

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

American Custom Chemicals Corporation
1-(BROMODIFLUOROMETHYL)CYCLOHEX-1-ENE 95.00%
5G
$ 848.93

AHH
1-(Bromodifluoromethyl)cyclohex-1-ene 97%
50g
$ 340.00

Total 15 raw suppliers

Chemical Property of 1-(Bromodifluoromethyl)cyclohex-1-ene

Chemical Property:

Vapor Pressure:1.42E-05mmHg at 25°C
Boiling Point:124.5°Cat760mmHg
Flash Point:29.1°C
PSA：0.00000
Density:1.523g/cm³
LogP:3.47450
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:209.98557
Heavy Atom Count:10
Complexity:152

Purity/Quality:

99%, ^*data from raw suppliers

1-(BROMODIFLUOROMETHYL)CYCLOHEX-1-ENE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 1-(Bromodifluoromethyl)cyclohex-1-ene

There total 3 articles about 1-(Bromodifluoromethyl)cyclohex-1-ene 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: 40.0%

: 14737-09-8
cis/trans-1-bromodifluoromethyl-2-bromocyclohexane

: 117711-60-1
1-(bromodifluoromethyl)cyclohex-1-ene

Guidance literature:: With aluminum oxide; potassium fluoride; In acetonitrile; at 40 - 50 ℃; for 8h;
DOI:10.1016/0022-1139(93)03051-M DOI:10.1016/0022-1139(93)02954-D

Reference yield:

: 14737-09-8
cis/trans-1-bromodifluoromethyl-2-bromocyclohexane

: 636-82-8
cyclohexene-1-carboxylic acid

: 117711-62-3
cyclohex-1-enecarbonyl fluoride

: 117711-61-2
3-Difluoromethylene-cyclohexene

: 117711-60-1
1-(bromodifluoromethyl)cyclohex-1-ene

Guidance literature:: With potassium hydroxide; at 88 - 105 ℃;
DOI:10.1021/jo00261a041

Reference yield:

: 110-83-8
cyclohexene

: 117711-60-1
1-(bromodifluoromethyl)cyclohex-1-ene

Guidance literature:: Multi-step reaction with 2 steps

1: CrCl₃*6H₂O, Fe (powder) / ethanol / 10 h / 60 - 70 °C

2: 40 percent / KF/Al₂O₃ / acetonitrile / 8 h / 40 - 50 °C

With aluminum oxide; chromium chloride; potassium fluoride; iron; In ethanol; acetonitrile;
DOI:10.1016/0022-1139(93)02954-D