2-Bromobenzyl Phenyl Sulfone

Base Information

• Chemical Name: 2-Bromobenzyl Phenyl Sulfone
• CAS No.: 92022-50-9
• Molecular Formula: C13H11 Br O2 S
• Molecular Weight: 311.199
• DSSTox Substance ID: DTXSID70462792
• Nikkaji Number: J1.105.692J
• Wikidata: Q82287385
• Mol file: 92022-50-9.mol

Synonyms:2-Bromobenzyl Phenyl Sulfone;92022-50-9;1-(Benzenesulfonylmethyl)-2-bromobenzene;1-bromo-2-((phenylsulfonyl)methyl)benzene;1-Bromo-2-(phenylsulfonylmethyl)benzene;1-bromo-2-[(phenylsulfonyl)methyl]benzene;1-(phenylsulfonylmethyl)-2-bromobenzene;SCHEMBL4959331;DTXSID70462792;CQNGEPLMWCLSBR-UHFFFAOYSA-N;MFCD06797069;AKOS025295917;B2367;FT-0642216;T71458

Chemical Property of 2-Bromobenzyl Phenyl Sulfone

Chemical Property:

• Vapor Pressure: 1.57E-08mmHg at 25°C
• Refractive Index: 1.615
• Boiling Point: 469.3°C at 760 mmHg
• Flash Point: 237.6°C
• PSA: 42.52000
• Density: 1.495g/cm³
• LogP: 4.50380
• Solubility.: slightly sol. in Methanol
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 309.96631
• Heavy Atom Count: 17
• Complexity: 328

Purity/Quality:

97% ^*data from raw suppliers

2-Bromobenzyl Phenyl Sulfone >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)CC2=CC=CC=C2Br

Technology Process of 2-Bromobenzyl Phenyl Sulfone

There total 11 articles about 2-Bromobenzyl Phenyl Sulfone 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: 96.0%

sodium benzenesulfonate (873-55-2) → 1-bromo-2-((phenylsulfonyl)methyl)benzene (92022-50-9)

Guidance literature:

With tetra-n-propylammonium bromide; In acetonitrile; at 80 ℃; for 24h;

DOI:10.1055/s-2004-822311

Reference yield: 90.0%

sodium benzenesulfonate (873-55-2) + 1-Bromo-2-bromomethyl-benzene (3433-80-5) → 1-bromo-2-((phenylsulfonyl)methyl)benzene (92022-50-9)

Guidance literature:

In N,N-dimethyl-formamide; at 80 ℃; for 2h;

DOI:10.1021/jo9010574

Reference yield: 82.0%

(2?bromobenzyl)phenyl sulfide (13006-53-6) → 1-bromo-2-((phenylsulfonyl)methyl)benzene (92022-50-9)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 0 - 25 ℃; for 12h;

DOI:10.1002/asia.201801679

upstream raw materials:

lithium thiophenoxide

2-bromobenzylchloride

sodium benzenesulfonate

1-Bromo-2-bromomethyl-benzene

Downstream raw materials:

1,3-Bis-[2-benzenesulfonyl-2-(2-bromo-phenyl)-ethyl]-2-bromo-benzene

3-benzenesulfonyl-3H-indene-1-carboxylic acid ethyl ester

C₂₂H₁₂Br₂

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