1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol

Base Information

• Chemical Name: 1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol
• CAS No.: 138074-21-2
• Molecular Formula: C21H30F2
• Molecular Weight: 320.46
• DSSTox Substance ID: DTXSID60570158
• Mol file: 138074-21-2.mol

Synonyms:138074-21-2;1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol;1,3-difluoro-5-[4-(4-propylcyclohexyl)cyclohexyl]benzene;SCHEMBL2880327;SCHEMBL4616425;SCHEMBL4616428;SCHEMBL4616430;SCHEMBL16080742;SCHEMBL17083184;DTXSID60570158;JBLVUPDQNCHQFH-OPMHRUBESA-N;1-[trans-4-(trans-4-propylcyclohexyl)cyclohexyl]-3,5-difluorobenzene;3~3~,3~5~-Difluoro-1~4~-propyl-1~1~,1~2~,1~3~,1~4~,1~5~,1~6~,2~1~,2~2~,2~3~,2~4~,2~5~,2~6~-dodecahydro-1~1~,2~1~:2~4~,3~1~-terphenyl

Chemical Property of 1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol

Chemical Property:

• Boiling Point: 379.9±35.0 °C(Predicted)
• PSA: 0.00000
• Density: 1.023±0.06 g/cm3(Predicted)
• LogP: 6.84510
• XLogP3: 8.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 320.23155728
• Heavy Atom Count: 23
• Complexity: 330

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1CCC(CC1)C2CCC(CC2)C3=CC(=CC(=C3)F)F

Technology Process of 1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol

There total 21 articles about 1,3-Difluor-5-[trans-4-(trans-4-propylcyclohexyl)-cyclohexyl]-benzol 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: 64.6%

3,5-difluoro-1-(4-(trans-4-propylcyclohexyl)-1-cyclohexenyl)benzene → trans-4'-(3,5-difluorophenyl)-trans-4-propylbicyclohexyl (138074-21-2)

Guidance literature:

With hydrogen; nickel; In Solmix A-11; toluene; for 48h;

Reference yield:

2,6-difluoro-4-(4-(trans-4-propylcyclohexyl)-1-cyclohexenyl)benzene → 3,5-difluoro-4-(4-(trans-4-propylcyclohexyl)-1-cyclohexyl) benzene (138074-21-2)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; In ethanol; toluene; at 40 ℃; for 5h; under 3750.38 Torr; Autoclave;

Reference yield:

3,5-difluoro-1-(4-(trans-4-propylcyclohexyl)-1-cyclohexenyl)benzene → 3,5-difluoro-1-(4-(trans-4-propylcyclohexyl)-1-cyclohexyl)benzene (138074-21-2)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; In ethanol; toluene; at 40 ℃; for 5h; under 3750.38 Torr; Autoclave;

upstream raw materials:

4-(trans-4-n-propylcyclohexyl)cyclohexanone

3,5-difluorobromobenzene