2,8-Dinitrodibenzothiophene

Base Information

• Chemical Name: 2,8-Dinitrodibenzothiophene
• CAS No.: 109041-38-5
• Molecular Formula: C₁₂H₆N₂O₄S
• Molecular Weight: 274.257
• Hs Code.: 2934999090
• European Community (EC) Number: 635-092-7
• DSSTox Substance ID: DTXSID60404242
• Nikkaji Number: J364.305K
• Wikidata: Q82208323
• Mol file: 109041-38-5.mol

Synonyms:2,8-dinitrodibenzothiophene;109041-38-5;Dibenzothiophene,2,8-dinitro-;SCHEMBL11118149;DTXSID60404242;2,8-dinitrodibenzo[b,d]thiophene;AKOS003235632

Chemical Property of 2,8-Dinitrodibenzothiophene

Chemical Property:

• Boiling Point: 508.3±30.0 °C(Predicted)
• PSA: 119.88000
• Density: 1.605±0.06 g/cm3(Predicted)
• LogP: 4.91730
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 274.00482785
• Heavy Atom Count: 19
• Complexity: 358

Purity/Quality:

99% ^*data from raw suppliers

2,8-DINITRODIBENZOTHIOPHENE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C3=C(S2)C=CC(=C3)[N+](=O)[O-]

Technology Process of 2,8-Dinitrodibenzothiophene

There total 3 articles about 2,8-Dinitrodibenzothiophene 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:

→ 2,8-dinitrodibenzothiophene (109041-38-5)

Guidance literature:

With nitric acid; at 40 ℃;

Reference yield:

→ 2,8-dinitrodibenzothiophene (109041-38-5)

Guidance literature:

With nitric acid; acetic anhydride; acetic acid; at 20 - 40 ℃; weiteres Nebenprod_.: Diphenylensulfoxyd;

Reference yield:

→ 2,8-dinitrodibenzothiophene (109041-38-5)

Guidance literature:

2,2'-Dibrom-5,5'-dinitro-diphenyl, Natriumpolysulfid/Δ/EtOH-H2O ( neben 6,2'-Dibrom-5'-nitro-3-amino-diphenyl);

DOI:10.1039/jr9600000414