Pentachloro(2,3-dibromopropoxy)benzene

Base Information

• Chemical Name: Pentachloro(2,3-dibromopropoxy)benzene
• CAS No.: 42115-16-2
• Molecular Formula: C9H5 Br2 Cl5 O
• Molecular Weight: 466.211
• Hs Code.: 2909309090
• European Community (EC) Number: 255-659-9
• DSSTox Substance ID: DTXSID90962289
• Nikkaji Number: J278.332K
• Mol file: 42115-16-2.mol

Synonyms:EINECS 255-659-9;Pentachloro(2,3-dibromopropoxy)benzene;42115-16-2;1,2,3,4,5-pentachloro-6-(2,3-dibromopropoxy)benzene;C9H5Br2Cl5O;C9-H5-Br2-Cl5-O;DTXSID90962289;2,3,4,5,6-Pentachloro-1-(2,3-dibromopropoxy)benzene

Chemical Property of Pentachloro(2,3-dibromopropoxy)benzene

Chemical Property:

• Vapor Pressure: 2.86E-08mmHg at 25°C
• Boiling Point: 461.8°Cat760mmHg
• Flash Point: 233.1°C
• PSA: 9.23000
• Density: 2.001g/cm³
• LogP: 6.49080
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 465.70998
• Heavy Atom Count: 17
• Complexity: 231

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(C(CBr)Br)OC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl

Technology Process of Pentachloro(2,3-dibromopropoxy)benzene

There total 2 articles about Pentachloro(2,3-dibromopropoxy)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:

allyloxypentachlorobenzene (42115-15-1) → (2,3-dibromo-propyl)-pentachlorophenyl ether (42115-16-2)

Guidance literature:

With chloroform; bromine;

DOI:10.1021/jo01166a015

Reference yield:

sodium pentachlorphenate (131-52-2) → (2,3-dibromo-propyl)-pentachlorophenyl ether (42115-16-2)

Guidance literature:

Multi-step reaction with 2 steps

1: ethanol

2: chloroform; bromine

With ethanol; chloroform; bromine;

DOI:10.1021/jo01166a015

upstream raw materials:

allyloxypentachlorobenzene

sodium pentachlorphenate