4-Chlorobenzyl radical

Base Information

• Chemical Name: 4-Chlorobenzyl radical
• CAS No.: 3327-51-3
• Molecular Formula: C7H7Cl
• Molecular Weight: 125.578
• Nikkaji Number: J416.642F,J1.964.060D
• Mol file: 3327-51-3.mol

Synonyms:4-Chlorobenzyl radical;3327-51-3

Chemical Property of 4-Chlorobenzyl radical

Chemical Property:

• Boiling Point: 162.4oC
• PSA: 0.00000
• LogP: 2.64840
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 125.0158029
• Heavy Atom Count: 8
• Complexity: 62.8

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [CH2]C1=CC=C(C=C1)Cl

Technology Process of 4-Chlorobenzyl radical

There total 7 articles about 4-Chlorobenzyl radical 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:

1-Chloro-4-(chloromethyl)benzene (104-83-6) → 4-chlorobenzyl radical (3327-51-3)

Guidance literature:

In hexane; Ambient temperature; Irradiation;

DOI:10.1021/ja00198a004

Reference yield:

para-chlorotoluene (106-43-4) → 4-chlorobenzyl radical (3327-51-3)

Guidance literature:

With nitrate radical; In acetonitrile; at 20 ℃; Rate constant;

DOI:10.1021/jo00271a038

Reference yield:

para-chlorotoluene (106-43-4) + phenylthiyl (4985-62-0) → 4-chlorobenzyl radical (3327-51-3) + thiophenol (108-98-5)

Guidance literature:

at 59.9 ℃; Rate constant; Thermodynamic data; activation energy investigated;

upstream raw materials:

4-chlorophenylacetic Acid

para-chlorotoluene

1,3-di(4-chlorophenyl)-2-propanone

1-Chloro-4-(chloromethyl)benzene

Downstream raw materials:

1,2-bis(4-chlorophenyl)ethane

Refernces

• 1、 Ito, Osamu,Akhido, Seiji,Iino, Masashi. "Kinetic Study for Reactions of Nitrate Radical (NO3.) with Substituted Toluenes in Acetonitrile Solution". . p. 2436 - 2440. Retrieved 2007/10/02.
• 2、 Tokumura, Kunihiro,Ozaki, Tomomi,Itoh, Michiya. "Hydrogen-Abstraction Reactivity of Excited-State Para-Substituted Benzyl Radicals in Solution at Room Temperature". . p. 5999 - 6004. Retrieved 2007/10/02.