Phenyl 2-phenylethenesulfonate

Base Information

• Chemical Name: Phenyl 2-phenylethenesulfonate
• CAS No.: 5305-91-9
• Molecular Formula: C14H12O3S
• Molecular Weight: 260.3083
• DSSTox Substance ID: DTXSID30364364
• Nikkaji Number: J2.644.433K
• Wikidata: Q82148290
• ChEMBL ID: CHEMBL443343
• Mol file: 5305-91-9.mol

Synonyms:phenyl 2-phenylethenesulfonate;CHEMBL443343;5305-91-9;phenyl (E)-2-phenylethenesulfonate;MLS000531990;phenyl 2-phenylethylenesulfonate;SCHEMBL14492053;DTXSID30364364;HMS2437I08;BDBM50275950;AKOS008677840;2-Phenylethenesulfonic acid phenyl ester;SMR000136933;phenyl (E)-2-phenyl-1-ethene-1-sulfonate;AB00079696-01;SR-01000203738;SR-01000203738-1

Chemical Property of Phenyl 2-phenylethenesulfonate

Chemical Property:

• Vapor Pressure: 0.000217mmHg at 25°C
• Boiling Point: 336.5°Cat760mmHg
• Flash Point: 157.3°C
• Density: 1.28g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 260.05071541
• Heavy Atom Count: 18
• Complexity: 355

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CS(=O)(=O)OC2=CC=CC=C2
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/S(=O)(=O)OC2=CC=CC=C2

Technology Process of Phenyl 2-phenylethenesulfonate

There total 2 articles about Phenyl 2-phenylethenesulfonate 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:

3,9-dichloro-2,4,8,10-tetraoxa-3,9-diphospha-spiro[5.5]undecane 3,9-disulfide (5305-81-7) + 4-chloro-2-nitrophenol sodium salt (52106-89-5) → 3,9-Bis-(4-chlor-2-nitro-phenoxy)-2,4,8,10-tetraoxa-3,9-diphospha-spiro<5,5>undecan-3,9-disulfid (5305-91-9)

Guidance literature:

With N,N-dimethyl acetamide;

Reference yield:

→ 3,9-Bis-(4-chlor-2-nitro-phenoxy)-2,4,8,10-tetraoxa-3,9-diphospha-spiro<5,5>undecan-3,9-disulfid (5305-91-9)

Guidance literature:

3,9-Dichlorid, Kalium-4-chlor-2-nitrophenolat;

upstream raw materials:

3,9-dichloro-2,4,8,10-tetraoxa-3,9-diphospha-spiro[5.5]undecane 3,9-disulfide

4-chloro-2-nitrophenol sodium salt

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