4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine

Base Information

Chemical Name:4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine
CAS No.:1245643-16-6
Molecular Formula:C9H15F2N
Molecular Weight:175
Hs Code.:2921300090
DSSTox Substance ID:DTXSID80700096
Wikidata:Q82631280
Mol file:1245643-16-6.mol

Synonyms:4-(DIFLUOROMETHYL)BICYCLO[2.2.2]OCTAN-1-AMINE;1245643-16-6;Bicyclo[2.2.2]octan-1-amine, 4-(difluoromethyl)-;SCHEMBL2823621;DTXSID80700096;AT34628;CS-0184330;FT-0738410;EN300-734926

Suppliers and Price of 4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine

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 4 raw suppliers

Chemical Property of 4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine

Chemical Property:

PSA：26.02000
LogP:3.00350
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:175.11725581
Heavy Atom Count:12
Complexity:166

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2(CCC1(CC2)C(F)F)N

Technology Process of 4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine

There total 6 articles about 4-(Difluoromethyl)bicyclo[2.2.2]octan-1-amine 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:

: 1252672-41-5
benzyl (4-(difluoromethyl)bicycio[2.2,2]octan-1-yl)carbamate

: 1245643-16-6
4-(difluoromethyl)bicyclo[2.2.2]octan-1-amine

Guidance literature:: With hydrogen; 20 % Pd(OH)2/C; In methanol; at 20 ℃; for 0.5h;

Reference yield:

: 18720-35-9
bicyclo[2.2.2]octane-1,4-dicarboxylic acid monomethyl ester

: 1245643-16-6
4-(difluoromethyl)bicyclo[2.2.2]octan-1-amine

Guidance literature:: Multi-step reaction with 6 steps

1.1: diphenyl phosphoryl azide; triethylamine / toluene / 2 h / 20 - 110 °C

1.2: 16 h / 110 °C

2.1: sodium hydroxide; water / methanol / 2 h / 65 °C

3.1: borane-THF / tetrahydrofuran / 2 h / 0 - 20 °C

4.1: pyridinium chlorochromate / dichloromethane / 2 h / 0 - 20 °C

5.1: diethylamino-sulfur trifluoride / dichloromethane / 2 h / 0 - 20 °C

6.1: palladium 10% on activated carbon; hydrogen / dichloromethane / 16 h / 20 °C / 760.05 Torr

With borane-THF; diethylamino-sulfur trifluoride; diphenyl phosphoryl azide; palladium 10% on activated carbon; water; hydrogen; triethylamine; pyridinium chlorochromate; sodium hydroxide; In tetrahydrofuran; methanol; dichloromethane; toluene;

Reference yield:

: 862501-91-5
methyl 4-(((benzyloxy)carbonyl)amino)bicyclo[2.2.2]octane-1-carboxylate

: 1245643-16-6
4-(difluoromethyl)bicyclo[2.2.2]octan-1-amine

Guidance literature:: Multi-step reaction with 5 steps

1: sodium hydroxide; water / methanol / 2 h / 65 °C

2: borane-THF / tetrahydrofuran / 2 h / 0 - 20 °C

3: pyridinium chlorochromate / dichloromethane / 2 h / 0 - 20 °C

4: diethylamino-sulfur trifluoride / dichloromethane / 2 h / 0 - 20 °C

5: palladium 10% on activated carbon; hydrogen / dichloromethane / 16 h / 20 °C / 760.05 Torr

With borane-THF; diethylamino-sulfur trifluoride; palladium 10% on activated carbon; water; hydrogen; pyridinium chlorochromate; sodium hydroxide; In tetrahydrofuran; methanol; dichloromethane;