Bicyclohexyl-3,3'-diene

Base Information

• Chemical Name: Bicyclohexyl-3,3'-diene
• CAS No.: 37746-25-1
• Molecular Formula: C12H18
• Molecular Weight: 162.275
• European Community (EC) Number: 694-979-7
• DSSTox Substance ID: DTXSID401315090
• Nikkaji Number: J1.942.127I
• Mol file: 37746-25-1.mol

Synonyms:Bicyclohexyl-3,3'-diene;bi-3-cyclohexen-1-yl;1,1'-Bi(3-cyclohexene);37746-25-1;DTXSID401315090

Chemical Property of Bicyclohexyl-3,3'-diene

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 162.140850574
• 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: C1CC(CC=C1)C2CCC=CC2

Technology Process of Bicyclohexyl-3,3'-diene

There total 12 articles about Bicyclohexyl-3,3'-diene 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: 86.0%

4,4′-dihydroxybicyclohexyl (20601-38-1,46310-12-7) → [1,1'-bis(cyclohexane)]-3,3'-diene (37746-25-1)

Guidance literature:

With sulfuric acid; In 5,5-dimethyl-1,3-cyclohexadiene; at 145 ℃; for 15h; Reagent/catalyst; Solvent;

Reference yield: 85.0%

4,4'-isopropylidenedicyclohexanol (13804-54-1,13804-57-4,13804-58-5,80-04-6) → [1,1'-bis(cyclohexane)]-3,3'-diene (37746-25-1)

Guidance literature:

With sulfuric acid; sodium sulfate; In 5,5-dimethyl-1,3-cyclohexadiene; at 145 ℃; for 15h; Reagent/catalyst;

Reference yield:

C12H20Br2 → [1,1'-bis(cyclohexane)]-3,3'-diene (37746-25-1)

Guidance literature:

With sodium hydroxide; In dichloromethane; water; at 10 - 60 ℃; for 5h;

upstream raw materials:

4-ethenylcyclohexene

buta-1,3-diene

cyclohexene

4,4′-dihydroxybicyclohexyl

Downstream raw materials:

(3,4,3',4'-diepoxy)bicyclohexyl

4-(4-bromophenyl)bromobenzene

Refernces

• 1、 -. "Bicyclic oxide preparation method (by machine translation)". Paragraph 0097; 0098; 0099; 0100; 0110; 0111. . Retrieved 2018/05/16.
• 2、 -. "Method for producing cyclic olefin compound". Paragraph 0043. . Retrieved 2016/10/09.