Phenol, 2-cyclohexyl-6-isopropyl-

Base Information

• Chemical Name: Phenol, 2-cyclohexyl-6-isopropyl-
• CAS No.: 74927-00-7
• Molecular Formula: C₁₅H₂₂O
• Molecular Weight: 218.339
• DSSTox Substance ID: DTXSID90225902
• Nikkaji Number: J79.292F
• Wikidata: Q83105096
• ChEMBL ID: CHEMBL283273
• Mol file: 74927-00-7.mol

Synonyms:2-Cyclohexyl-6-isopropylphenol;Phenol, 2-cyclohexyl-6-isopropyl-;BRN 3280307;4-06-00-03959 (Beilstein Handbook Reference);74927-00-7;CHEMBL283273;DTXSID90225902;LS-104286

Chemical Property of Phenol, 2-cyclohexyl-6-isopropyl-

Chemical Property:

• Vapor Pressure: 0.00321mmHg at 25°C
• Boiling Point: 274.5°Cat760mmHg
• Flash Point: 126°C
• Density: 0.996g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 218.167065321
• Heavy Atom Count: 16
• Complexity: 206

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=CC(=C1O)C2CCCCC2

Technology Process of Phenol, 2-cyclohexyl-6-isopropyl-

There total 4 articles about Phenol, 2-cyclohexyl-6-isopropyl- 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:

2-(1-methylethyl)phenol (88-69-7) + cyclohexene (110-83-8) → 2-Cyclohexyl-6-isopropyl-phenol (74927-00-7)

Guidance literature:

With aluminium; Yield given. Multistep reaction; 1.) 120 deg C, 2 h, 2.) a) from 40 deg C to 200 deg C, 4 h, b) 200 deg C, 2 h;

DOI:10.1021/jm00186a013

Reference yield:

propene (187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4) + 2-cyclohexylphenol (119-42-6) → 2-Cyclohexyl-6-isopropyl-phenol (74927-00-7)

Guidance literature:

With aluminium; at 200 - 220 ℃;

Reference yield:

cyclohexane (110-82-7,25012-93-5) → 2-Cyclohexyl-6-isopropyl-phenol (74927-00-7)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminium phenolate / 240 °C

2: aluminium / 200 - 220 °C

With aluminium(III) phenoxide; aluminium;

upstream raw materials:

propene

2-cyclohexylphenol

2-(1-methylethyl)phenol

cyclohexene

Downstream raw materials:

1,1'-dicyclohexyl-5,5'-diisopropyl-[3,3']bicyclohexa-1,4-dienylidene-6,6'-dione

Refernces