2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol

Base Information

• Chemical Name: 2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol
• CAS No.: 56187-92-9
• Molecular Formula: C19H24 O
• Molecular Weight: 268.399
• European Community (EC) Number: 260-042-2
• DSSTox Substance ID: DTXSID10204734
• Nikkaji Number: J296.603D
• Wikidata: Q83078169
• Mol file: 56187-92-9.mol

Synonyms:56187-92-9;2-tert-butyl-4-(2-phenylpropan-2-yl)phenol;2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol;EINECS 260-042-2;SCHEMBL7705085;DTXSID10204734;2-t-Butyl-4-(dimethylbenzyl)phenol;AKOS024280572;2-tert-Butyl-4-(1-methyl-1-phenylethyl)phenol #;2-tert-Butyl-4-(alpha,alpha-dimethylbenzyl)phenol;2-(1,1-dimethylethyl)-4(1-methyl-1-phenylethyl)-phenol;Phenol, 2-(1,1-dimethylethyl)-4-(1-methyl-1-phenylethyl)-

Chemical Property of 2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol

Chemical Property:

• Vapor Pressure: 1.22E-05mmHg at 25°C
• Boiling Point: 358.5°Cat760mmHg
• Flash Point: 166.3°C
• PSA: 20.23000
• Density: 1.002g/cm³
• LogP: 5.01560
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 268.182715385
• Heavy Atom Count: 20
• Complexity: 306

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=C(C=CC(=C1)C(C)(C)C2=CC=CC=C2)O

Technology Process of 2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol

There total 2 articles about 2-(1,1-Dimethylethyl)-4-(1-methyl-1-phenylethyl)phenol 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: 91.0%

2-tert-Butylphenol (88-18-6) + isopropenylbenzene (98-83-9,6144-04-3,25014-31-7,42612-14-6) → 2-t-butyl-4-(α,α-dimethylbenzyl)phenol (56187-92-9)

Guidance literature:

With aluminium; phenol; at 130 ℃; for 4h;

DOI:10.1007/s11172-007-0170-5

Reference yield: 50.0%

p-cumylphenol (599-64-4) + tert-butyl alcohol (75-65-0) → 2-t-butyl-4-(α,α-dimethylbenzyl)phenol (56187-92-9)

Guidance literature:

With sulfuric acid; acetic acid; at 40 ℃; for 24h; Inert atmosphere;

DOI:10.1021/ja501789x

Reference yield: 88.0%

2-t-butyl-4-(α,α-dimethylbenzyl)phenol (56187-92-9) → C38H46O2 (1609538-08-0)

Guidance literature:

With oxygen; triethylamine; copper(l) chloride; In dichloromethane; at 23 ℃; for 1h; under 760.051 Torr;

DOI:10.1021/ja501789x

upstream raw materials:

2-tert-Butylphenol

isopropenylbenzene

p-cumylphenol

tert-butyl alcohol

Downstream raw materials:

2-tert-Butyl-4-(1-methyl-1-phenyl-ethyl)-6-(2-nitro-phenylazo)-phenol

2-(2'H-benzotriazol-2'-yl)-6-t-butylphenol

2-(2'H-benzotriazol-2'-yl)-4-(α,α-dimethylbenzyl)phenol

2-(2'H-benzotrizol-2'-yl)-6-t-butyl-4-(α,α-dimethylbenzyl)phenol

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