1-Methyl-2-(3-phenylpropyl)benzene

Base Information

• Chemical Name: 1-Methyl-2-(3-phenylpropyl)benzene
• CAS No.: 1520-39-4
• Molecular Formula: C16H18
• Molecular Weight: 210.319
• NSC Number: 54374
• DSSTox Substance ID: DTXSID00288144
• Nikkaji Number: J3.479.282H
• Wikidata: Q82024442
• Mol file: 1520-39-4.mol

Synonyms:1520-39-4;1-methyl-2-(3-phenylpropyl)benzene;o-phenylxylylethane;NSC54374;DTXSID00288144;NSC-54374

Chemical Property of 1-Methyl-2-(3-phenylpropyl)benzene

Chemical Property:

• Vapor Pressure: 0.00114mmHg at 25°C
• Boiling Point: 309.7°Cat760mmHg
• Flash Point: 145.6°C
• Density: 0.974g/cm³
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 210.140850574
• Heavy Atom Count: 16
• Complexity: 179

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1CCCC2=CC=CC=C2

Technology Process of 1-Methyl-2-(3-phenylpropyl)benzene

There total 15 articles about 1-Methyl-2-(3-phenylpropyl)benzene 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: 98.0%

(4-4′-di-tert-butyl-2,2′-bipyridine)NiII(2-tolyl)(I) (1474011-55-6) + 1,3-dioxoisoindolin-2-yl 4-phenylbutanoate (1841512-58-0) → 1-methyl-2-(3-phenylpropyl)benzene (1520-39-4)

Guidance literature:

With zinc; In N,N-dimethyl-formamide; at 20 ℃; for 6h; Reagent/catalyst; Inert atmosphere; Sealed tube;

DOI:10.1021/jacs.6b01533

Reference yield: 92.0%

1-Bromo-3-phenylpropane (637-59-2) + 2-Methylphenylboronic acid (16419-60-6) → 1-methyl-2-(3-phenylpropyl)benzene (1520-39-4)

Guidance literature:

1-Bromo-3-phenylpropane; With Pd(P(t-Bu)2Me)2; In diethyl ether; at 0 ℃;

2-Methylphenylboronic acid; With potassium tert-butylate; In tert-Amyl alcohol; at 20 ℃; for 16h; Further stages.;

DOI:10.1021/ja0283899

Reference yield: 91.0%

ortho-tolylmagnesium bromide (932-31-0) + 1-Bromo-3-phenylpropane (637-59-2) → 1-methyl-2-(3-phenylpropyl)benzene (1520-39-4)

Guidance literature:

With copper(l) iodide; lithium chloride; In tetrahydrofuran; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1016/j.tetlet.2014.08.089

upstream raw materials:

2-(3-phenylpropyl)benzylalcohol

Dimethyl-(3-phenyl-propyl)-benzyl-ammonium bromid

methylene chloride

1-Bromo-3-phenylpropane