p-Cumylphenyl acetate

Base Information

• Chemical Name: p-Cumylphenyl acetate
• CAS No.: 24133-73-1
• Molecular Formula: C17H18 O2
• Molecular Weight: 254.329
• Hs Code.: 2915390090
• European Community (EC) Number: 246-026-8
• NSC Number: 6730
• DSSTox Substance ID: DTXSID20885255
• Nikkaji Number: J242.736B
• Wikidata: Q82863868
• Mol file: 24133-73-1.mol

Synonyms:p-Cumylphenyl acetate;24133-73-1;4-(1-Methyl-1-phenylethyl)phenyl acetate;Phenol, 4-(1-methyl-1-phenylethyl)-, acetate;NSC 6730;Phenol, 4-(1-methyl-1-phenylethyl)-, 1-acetate;EINECS 246-026-8;AI3-17443;Phenol, p-(alpha,alpha-dimethylbenzyl)-, acetate;SCHEMBL2335333;DTXSID20885255;NSC6730;NSC-6730;Phenol,.alpha.-dimethylbenzyl)-, acetate;Acetic acid 4-(alpha,alpha-dimethylbenzyl)phenyl ester

Chemical Property of p-Cumylphenyl acetate

Chemical Property:

• Vapor Pressure: 3.43E-05mmHg at 25°C
• Boiling Point: 354.1°Cat760mmHg
• Flash Point: 121°C
• PSA: 26.30000
• Density: 1.058g/cm³
• LogP: 3.93780
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 254.130679813
• Heavy Atom Count: 19
• Complexity: 294

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC=C(C=C1)C(C)(C)C2=CC=CC=C2

Technology Process of p-Cumylphenyl acetate

There total 3 articles about p-Cumylphenyl acetate 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: 98.4%

p-cumylphenol (599-64-4) + acetic anhydride (108-24-7) + acetic acid (64-19-7,77671-22-8) → 4-(1-methyl-1-phenylethyl)phenyl acetate (24133-73-1)

Guidance literature:

With phosphoric acid; at 90 - 95 ℃; for 4h; Inert atmosphere;

Reference yield: 97.0%

Isopropenyl acetate (108-22-5) + p-cumylphenol (599-64-4) → 4-(1-methyl-1-phenylethyl)phenyl acetate (24133-73-1)

Guidance literature:

With iodine; at 85 - 90 ℃; for 0.0833333h;

DOI:10.1016/j.tetlet.2006.05.122

Reference yield:

→ 4-(1-methyl-1-phenylethyl)phenyl acetate (24133-73-1)

Guidance literature:

4-Cumylphenol, Acetanhydrid, H3PO4, Δ;

upstream raw materials:

Isopropenyl acetate

p-cumylphenol

acetic anhydride

acetic acid

Downstream raw materials:

4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol)

1-acetyl-4-{1-methyl-1-(4-acetyloxyphenyl)ethyl}benzene

1-acetyl-4-{1-methyl-1-(4-hydroxyphenyl)ethyl}benzene

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