(4-Butylcyclohexyl)benzene

Base Information

• Chemical Name: (4-Butylcyclohexyl)benzene
• CAS No.: 61203-95-0
• Molecular Formula: C16H24
• Molecular Weight: 216.367
• Hs Code.: 2902909090
• European Community (EC) Number: 612-102-8
• DSSTox Substance ID: DTXSID501302600
• Nikkaji Number: J1.629.387C
• Mol file: 61203-95-0.mol

Synonyms:(4-BUTYLCYCLOHEXYL)BENZENE;61203-95-0;TRANS-1-BUTYL-4-PHENYLCYCLOHEXANE;37909-94-7;(trans-4-Butylcyclohexyl)benzene;DTXSID501302600;AKOS015964014

Chemical Property of (4-Butylcyclohexyl)benzene

Chemical Property:

• Vapor Pressure: 0.00135mmHg at 25°C
• Refractive Index: 1.497
• Boiling Point: 307°C at 760 mmHg
• Flash Point: 134.7°C
• PSA: 0.00000
• Density: 0.896g/cm³
• LogP: 5.15060
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 216.187800766
• Heavy Atom Count: 16
• Complexity: 171

Purity/Quality:

99% ^*data from raw suppliers

TRANS-1-BUTYL-4-PHENYLCYCLOHEXANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1CCC(CC1)C2=CC=CC=C2

Technology Process of (4-Butylcyclohexyl)benzene

There total 2 articles about (4-Butylcyclohexyl)benzene 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: 85.0%

bromobenzene (108-86-1,52753-63-6) + 4-butylcyclohexylmagnesium bromide → trans-1-butyl-4-phenylcyclohexane (61203-95-0)

Guidance literature:

With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; In diethyl ether; for 0.25h; Ambient temperature;

Reference yield:

trans-1-(4-fenilcicloesil)-1-pentanone (73011-78-6) → trans-1-butyl-4-phenylcyclohexane (61203-95-0)

Guidance literature:

With potassium hydroxide; hydrazine hydrate; In diethylene glycol; for 1h; Heating;

DOI:10.1080/00268948208072585

Reference yield: 89.0%

acetyl chloride (75-36-5) + trans-1-butyl-4-phenylcyclohexane (61203-95-0) → 4-(trans-4-butylcyclohexyl)acetophenone (83626-30-6)

Guidance literature:

With aluminium trichloride; In dichloromethane; at 0 ℃; overnight;

upstream raw materials:

trans-1-(4-fenilcicloesil)-1-pentanone

bromobenzene

Downstream raw materials:

4-(trans-4-butylcyclohexyl)acetophenone

(S)-1-[4-(trans-4-butylcyclohexyl)phenyl]-2-phenylpropane-1-one

trans-4-butyl-(4-cyanophenyl) cyclohexane

p-(4-trans-butylcyclohexyl)benzoic acid