4-Isopropylphenylacetonitrile

Base Information

• Chemical Name: 4-Isopropylphenylacetonitrile
• CAS No.: 4395-87-3
• Molecular Formula: C11H13N
• Molecular Weight: 159.231
• Hs Code.: 2926909090
• Mol file: 4395-87-3.mol

Synonyms:4-Isopropylphenylacetonitrile, 98+%;Benzeneacetonitrile, 4-(1-methylethyl)- (9CI);2-(4-isopropylphenyl)acetonitrile;2-(4-propan-2-ylphenyl)ethanenitrile;

Chemical Property of 4-Isopropylphenylacetonitrile

Chemical Property:

• Vapor Pressure: 0.0118mmHg at 25°C
• Refractive Index: n20/D 1.5125(lit.)
• Boiling Point: 261.1 °C at 760 mmHg
• Flash Point: 117.5 °C
• PSA: 23.79000
• Density: 0.96 g/cm³
• LogP: 2.87608
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

4-Isopropylphenylacetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 20/21/22
• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Technology Process of 4-Isopropylphenylacetonitrile

There total 11 articles about 4-Isopropylphenylacetonitrile 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: 100.0%

sodium cyanide (143-33-9,25596-52-5) + 4-i-propylbenzyl bromide (73789-86-3) → (4-isopropylphenyl)acetonitrile (4395-87-3)

Guidance literature:

In ethanol; water; at 80 ℃; for 1.33333h;

Reference yield: 92.0%

sodium cyanide (143-33-9,25596-52-5) + 4-isopropylbenzyl chloride (2051-18-5) → (4-isopropylphenyl)acetonitrile (4395-87-3)

Guidance literature:

With sodium hydroxide; tetra(n-butyl)ammonium hydrogensulfate; In dichloromethane; water; for 1h; Heating;

Reference yield: 67.0%

cuminol (536-60-7) → (4-isopropylphenyl)acetonitrile (4395-87-3)

Guidance literature:

DOI:10.1016/S0957-4166(00)86155-8

upstream raw materials:

(4-isopropyl-phenyl)-acetaldehyde-oxime

potassium cyanide

4-isopropylbenzyl chloride

sodium cyanide

Downstream raw materials:

2-Cyano-2-(4-isopropyl-phenyl)-succinic acid diethyl ester

N-hydroxy-2-(4-isopropyl-phenyl)-acetamidine

3-Methyl-2-(4'-chlorophenyl)-butyronitrile

2,3-epoxy-4-(4-isopropyl-phenyl)-3-methyl-butyric acid ethyl ester

Refernces

• 1、 -. "PREVENTIVE OR THERAPEUTIC AGENT FOR KIDNEY DISEASE". Page 32. . Retrieved 2008/06/13.
• 2、 -. "5-AMIDINO-2-HYDROXYBENZENESULFONAMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES FOR THEIR PREPARATION". . . Retrieved 2008/06/13.