2-Chlorophenylmethyltriphenylphosphonium bromide

Base Information

• Chemical Name: 2-Chlorophenylmethyltriphenylphosphonium bromide
• CAS No.: 62640-67-9
• Molecular Formula: C25H21ClP.Br
• Molecular Weight: 467.772
• UNII: R8KN9GM2UD
• DSSTox Substance ID: DTXSID50587437
• Mol file: 62640-67-9.mol

Synonyms:62640-67-9;2-chlorophenylmethyltriphenylphosphonium bromide;R8KN9GM2UD;(2-chlorophenyl)methyl-triphenylphosphanium,bromide;SCHEMBL5829267;Phosphonium, [(2-chlorophenyl)methyl]triphenyl-, bromide;DTXSID50587437;BESBTDAIQCXZSB-UHFFFAOYSA-M;2-chlorobenzyltriphenylphosphonium bromide;[(2-Chlorophenyl)methyl]triphenylphosphonium bromide;[(2-Chlorophenyl)methyl](triphenyl)phosphanium bromide;Phosphonium, [(2-chlorophenyl)methyl]triphenyl-, bromide (1:1)

Chemical Property of 2-Chlorophenylmethyltriphenylphosphonium bromide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 466.02528
• Heavy Atom Count: 28
• Complexity: 386

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)[P+](CC2=CC=CC=C2Cl)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Technology Process of 2-Chlorophenylmethyltriphenylphosphonium bromide

There total 3 articles about 2-Chlorophenylmethyltriphenylphosphonium bromide 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: 88.0%

1-bromomethyl-2-chlorobenzene (611-17-6) + triphenylphosphine (603-35-0) → 1-(2'-chlorobenzyl)triphenylphosphonium bromide (62640-67-9)

Guidance literature:

at 100 ℃; for 0.166667h; Inert atmosphere; neat (no solvent);

DOI:10.1021/ja300943z

Reference yield:

1-chloro-2-(chloromethyl)benzene (611-19-8) + triphenylphosphine (603-35-0) → 1-(2'-chlorobenzyl)triphenylphosphonium bromide (62640-67-9)

Guidance literature:

In xylene; Heating;

DOI:10.1021/jo00036a021

Reference yield:

→ 2,4-diamino-6-(2-chlorophenylmethyl-5,6,7,8-tetrahydroquinazoline + 1-(2'-chlorobenzyl)triphenylphosphonium bromide (62640-67-9)

Guidance literature:

upstream raw materials:

1-chloro-2-(chloromethyl)benzene

triphenylphosphine

1-bromomethyl-2-chlorobenzene

Downstream raw materials:

3-[(2-Chloro-phenyl)-(triphenyl-λ⁵-phosphanylidene)-methyl]-4-phenyl-cyclobut-3-ene-1,2-dione

(E)-2,2'-dichlorostilbene

(Z)-1,2-bis(2-chlorophenyl)ethene

(Z)-1-chloro-2-styrylbenzene