4-Isopropylbenzyl phenylacetate

Base Information

• Chemical Name: 4-Isopropylbenzyl phenylacetate
• CAS No.: 94087-24-8
• Molecular Formula: C18H20 O2
• Molecular Weight: 268.356
• Hs Code.: 2916399090
• European Community (EC) Number: 301-917-1
• DSSTox Substance ID: DTXSID90240413
• Nikkaji Number: J368.036C
• Wikidata: Q83123261
• Mol file: 94087-24-8.mol

Synonyms:4-Isopropylbenzyl phenylacetate;94087-24-8;EINECS 301-917-1;DTXSID90240413;Benzeneacetic acid [4-(1-methylethyl)phenyl]methyl ester;Benzeneacetic acid, [4-(1-methylethyl)phenyl]methyl ester

Chemical Property of 4-Isopropylbenzyl phenylacetate

Chemical Property:

• Vapor Pressure: 8.95E-06mmHg at 25°C
• Boiling Point: 373.4°Cat760mmHg
• Flash Point: 134.4°C
• PSA: 26.30000
• Density: 1.06g/cm³
• LogP: 4.09590
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 268.146329876
• Heavy Atom Count: 20
• Complexity: 284

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=C(C=C1)COC(=O)CC2=CC=CC=C2

Technology Process of 4-Isopropylbenzyl phenylacetate

There total 1 articles about 4-Isopropylbenzyl phenylacetate 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:

phenylacetic acid (103-82-2) + cuminol (536-60-7) → phenyl-acetic acid-(4-isopropyl-benzyl ester) (94087-24-8)

Guidance literature:

With sulfuric acid;

upstream raw materials:

phenylacetic acid

cuminol