Benzene, (2-cyclohexen-1-yloxy)-

Base Information

• Chemical Name: Benzene, (2-cyclohexen-1-yloxy)-
• CAS No.: 5614-35-7
• Molecular Formula: C12H14O
• Molecular Weight: 174.243
• DSSTox Substance ID: DTXSID30452513
• Nikkaji Number: J861.342G
• Mol file: 5614-35-7.mol

Synonyms:Benzene, (2-cyclohexen-1-yloxy)-;5614-35-7;3-Phenoxycyclohexene;SCHEMBL4371441;DTXSID30452513;AKOS024321676;(2-CYCLOHEXEN-1-YLOXY)BENZENE

Chemical Property of Benzene, (2-cyclohexen-1-yloxy)-

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 174.104465066
• Heavy Atom Count: 13
• Complexity: 168

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC=CC(C1)OC2=CC=CC=C2

Technology Process of Benzene, (2-cyclohexen-1-yloxy)-

There total 12 articles about Benzene, (2-cyclohexen-1-yloxy)- 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: 79.0%

3-chloro-cyclohexene (2441-97-6) + phenol (108-95-2,27073-41-2) → 3-phenoxycyclohexene (5614-35-7)

Guidance literature:

With sodium hydroxide; In water; N,N-dimethyl-formamide; at 5 - 22 ℃; for 2.5h;

Reference yield: 77.0%

Cyclohex-2-enol (822-67-3) + phenol (108-95-2,27073-41-2) → 3-phenoxycyclohexene (5614-35-7)

Guidance literature:

With triphenylphosphine; diethylazodicarboxylate; In tetrahydrofuran; for 4h; Ambient temperature;

DOI:10.1021/jo982178y

Reference yield: 65.0%

rac-3-bromocyclohexene (1521-51-3,113667-32-6) + phenol (108-95-2,27073-41-2) → 3-phenoxycyclohexene (5614-35-7)

Guidance literature:

With potassium carbonate; sodium iodide; In acetone; for 12h; Reflux;

DOI:10.3390/molecules21040503

upstream raw materials:

trans-1,2-dibromocyclohexane

sodium phenoxide

rac-3-bromocyclohexene

phenol

Downstream raw materials:

3-(2-hydroxyphenyl)cyclohexene

2-phenoxy-adipic acid

1-(2-hydroxyphenyl)cyclohexene

1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan