Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester

Base Information

• Chemical Name: Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester
• CAS No.: 114542-00-6
• Molecular Formula: C₁₄H₁₆NO₆PS
• Molecular Weight: 357.324
• DSSTox Substance ID: DTXSID00449410
• Wikidata: Q82268861
• Mol file: 114542-00-6.mol

Synonyms:114542-00-6;Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester;DTXSID00449410

Chemical Property of Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 357.04359540
• Heavy Atom Count: 23
• Complexity: 498

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COP(=O)(OC)OC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2

Technology Process of Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester

There total 4 articles about Phosphoric acid, dimethyl 4-[(phenylsulfonyl)amino]phenyl ester 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: 45.0%

N-(phenylsulfonyl)-1,4-benzoquinone monoimine (4056-56-8) + phosphorous acid trimethyl ester (121-45-9) → N-(4-methoxyphenyl)benzenesulphonamide (7471-26-3) + p-benzenesulfonamidophenyl dimethyl phosphate (114542-00-6) + Dimethyl <2-hydroxy-5-phenyl>phosphonate (150081-90-6) + Dimethyl 4-phenyl phosphate

Guidance literature:

In benzene; for 2h; Further byproducts given; Ambient temperature;

Reference yield: 45.0%

N-(phenylsulfonyl)-1,4-benzoquinone monoimine (4056-56-8) + phosphorous acid trimethyl ester (121-45-9) → 4--1-methoxybenzene (14665-62-4) + N-(4-methoxyphenyl)benzenesulphonamide (7471-26-3) + p-benzenesulfonamidophenyl dimethyl phosphate (114542-00-6) + Dimethyl 4-phenyl phosphate

Guidance literature:

In benzene; for 2h; Further byproducts given; Ambient temperature;

Reference yield: 12.0%

N-(phenylsulfonyl)-1,4-benzoquinone monoimine (4056-56-8) + phosphorous acid trimethyl ester (121-45-9) → 4--1-methoxybenzene (14665-62-4) + N-(4-methoxyphenyl)benzenesulphonamide (7471-26-3) + p-benzenesulfonamidophenyl dimethyl phosphate (114542-00-6) + Dimethyl <2-hydroxy-5-phenyl>phosphonate (150081-90-6) + Dimethyl 4-phenyl phosphate

Guidance literature:

In benzene; for 2h; Mechanism; Ambient temperature; other substrate, other phosphite, other time;

upstream raw materials:

N-(phenylsulfonyl)-1,4-benzoquinone monoimine

phosphorous acid trimethyl ester

Dimethyl <2-hydroxy-5-phenyl>phosphonate