Phenoxathiin, 10,10-dioxide

Base Information

Chemical Name:Phenoxathiin, 10,10-dioxide
CAS No.:950-47-0
Molecular Formula:C12H8O3S
Molecular Weight:232.26
Hs Code.:2934999090
European Community (EC) Number:660-282-1
NSC Number:410
DSSTox Substance ID:DTXSID40241718
Nikkaji Number:J104.353F
Wikidata:Q83125290
ChEMBL ID:CHEMBL83434
Mol file:950-47-0.mol

Synonyms:Phenoxathiin, 10,10-dioxide;Phenoxathiine 10,10-dioxide;950-47-0;phenoxathiin 10,10-dioxide;BRN 0175481;CHEMBL83434;AI3-08431;NSC410;Phenoxathiin,10-dioxide;Phenoxathiine10,10-dioxide;Oprea1_268370;phenoxathiin-10,10-dioxide;CBDivE_014620;SCHEMBL3035516;DTXSID40241718;NSC 410;NSC-410;C12-H8-O3-S;10|E?-phenoxathiine-10,10-dione;BDBM50059270;STL302125;AKOS015958550;LS-105705

Suppliers and Price of Phenoxathiin, 10,10-dioxide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
Phenoxathiine10,10-dioxide 95+%
10g
$ 743.00

Crysdot
Phenoxathiine10,10-dioxide 95+%
5g
$ 495.00

Total 6 raw suppliers

Chemical Property of Phenoxathiin, 10,10-dioxide

Chemical Property:

Vapor Pressure:1.15E-06mmHg at 25°C
Boiling Point:413.4°Cat760mmHg
Flash Point:203.8°C
PSA：51.75000
Density:1.418g/cm³
LogP:3.70590
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:232.01941529
Heavy Atom Count:16
Complexity:329

Purity/Quality:

99% ^*data from raw suppliers

Phenoxathiine10,10-dioxide 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)OC3=CC=CC=C3S2(=O)=O

Technology Process of Phenoxathiin, 10,10-dioxide

There total 7 articles about Phenoxathiin, 10,10-dioxide 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: 98.0%

: 262-20-4
phenoxathiine

: 950-47-0
phenoxathiin S,S-dioxide

Guidance literature:: With dihydrogen peroxide; acetic acid;
DOI:10.1107/S0108270111042715

Reference yield:

: 1121-24-0
ortho-mercaptophenol

: 950-47-0
phenoxathiin S,S-dioxide

Guidance literature:: Multi-step reaction with 3 steps

2: t-BuOK / dimethylformamide / Heating

3: H₂O₂ / acetic acid

With potassium tert-butylate; dihydrogen peroxide; In acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00113a039

Reference yield:

: 577-19-5
2-nitrophenyl bromide

: 950-47-0
phenoxathiin S,S-dioxide

Guidance literature:: Multi-step reaction with 3 steps

2: t-BuOK / dimethylformamide / Heating

3: H₂O₂ / acetic acid

With potassium tert-butylate; dihydrogen peroxide; In acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00113a039