[4-(4-Bromophenoxy)phenyl]phosphonic acid

Base Information

• Chemical Name: [4-(4-Bromophenoxy)phenyl]phosphonic acid
• CAS No.: 46919-42-0
• Molecular Formula: C12H10BrO4P
• Molecular Weight: 329.087
• NSC Number: 129472
• DSSTox Substance ID: DTXSID80299334
• Wikidata: Q82041667
• Mol file: 46919-42-0.mol

Synonyms:46919-42-0;[4-(4-bromophenoxy)phenyl]phosphonic acid;NSC129472;SCHEMBL9331117;DTXSID80299334;NSC-129472

Chemical Property of [4-(4-Bromophenoxy)phenyl]phosphonic acid

Chemical Property:

• Vapor Pressure: 4.27E-10mmHg at 25°C
• Boiling Point: 481.9°Cat760mmHg
• Flash Point: 245.2°C
• Density: 1.73g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 327.95001
• Heavy Atom Count: 18
• Complexity: 303

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1OC2=CC=C(C=C2)Br)P(=O)(O)O

Technology Process of [4-(4-Bromophenoxy)phenyl]phosphonic acid

There total 4 articles about [4-(4-Bromophenoxy)phenyl]phosphonic acid 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:

4-phosphonic acid diphenyl ether (4042-62-0) → [4-(4-bromo-phenoxy)-phenyl]-phosphonic acid (46919-42-0)

Guidance literature:

With tetrachloromethane; bromine;

DOI:10.1039/jr9320002880

Reference yield:

diphenylether (101-84-8) → [4-(4-bromo-phenoxy)-phenyl]-phosphonic acid (46919-42-0)

Guidance literature:

Multi-step reaction with 3 steps

1: aluminium chloride; phosphorus (III)-chloride

2: chlorine / und Erwaermen des Reaktionsprodukts mit Wasser

3: tetrachloromethane; bromine

With tetrachloromethane; aluminium trichloride; bromine; chlorine; phosphorus trichloride;

DOI:10.1039/jr9320002880

Reference yield:

dichloro-(4-phenoxyphenyl)phosphine (42479-86-7) → [4-(4-bromo-phenoxy)-phenyl]-phosphonic acid (46919-42-0)

Guidance literature:

Multi-step reaction with 2 steps

1: chlorine / und Erwaermen des Reaktionsprodukts mit Wasser

2: tetrachloromethane; bromine

With tetrachloromethane; bromine; chlorine;

DOI:10.1039/jr9320002880

upstream raw materials:

4-phosphonic acid diphenyl ether

4,4'-dibromodiphenyl ether

diphenylether

dichloro-(4-phenoxyphenyl)phosphine

Downstream raw materials:

4,4'-dibromodiphenyl ether