Bis(4,5-dimethoxy-2-nitrophenyl)disulfide

Base Information

• Chemical Name: Bis(4,5-dimethoxy-2-nitrophenyl)disulfide
• CAS No.: 58249-73-3
• Molecular Formula: C16H16N2O8S2
• Molecular Weight: 428.444
• DSSTox Substance ID: DTXSID30886258
• Nikkaji Number: J429.363K
• Wikidata: Q82865037
• Mol file: 58249-73-3.mol

Synonyms:Bis(4,5-dimethoxy-2-nitrophenyl)disulfide;Disulfide, bis(4,5-dimethoxy-2-nitrophenyl);58249-73-3;DTXSID30886258;C16H16N2O8S2;Bis(4,5-dimethoxy-2-nitrophenyl) persulfide;3,4,3',4'-Tetramethoxy-6,6'-dinitro diphenyl diselfide;3,4,3',4'-Tetramethoxy-6,6'-dinitro diphenyl disulfide;1-[(4,5-Dimethoxy-2-nitrophenyl)disulfanyl]-4,5-dimethoxy-2-nitrobenzene #

Chemical Property of Bis(4,5-dimethoxy-2-nitrophenyl)disulfide

Chemical Property:

• Boiling Point: 593.3°Cat760mmHg
• Flash Point: 312.6°C
• PSA: 179.16000
• Density: 1.48g/cm³
• LogP: 5.38320
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 7
• Exact Mass: 428.03480782
• Heavy Atom Count: 28
• Complexity: 486

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C(=C1)[N+](=O)[O-])SSC2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OC

Technology Process of Bis(4,5-dimethoxy-2-nitrophenyl)disulfide

There total 4 articles about Bis(4,5-dimethoxy-2-nitrophenyl)disulfide 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:

1-bromo-4,5-dimethoxy-2-nitro-benzene (51072-66-3) → bis-(4,5-dimethoxy-2-nitro-phenyl)-disulfane (58249-73-3)

Guidance literature:

With sodium disulfide; ethanol;

DOI:10.1039/jr9490001503

Reference yield:

4,5-dimethoxy-1,2-dinitrobenzene (3395-03-7) → bis-(4,5-dimethoxy-2-nitro-phenyl)-disulfane (58249-73-3)

Guidance literature:

With methanol; sodium disulfide;

Reference yield:

1,2-dimethoxybenzene (91-16-7) → bis-(4,5-dimethoxy-2-nitro-phenyl)-disulfane (58249-73-3)

Guidance literature:

Multi-step reaction with 2 steps

1: glacial acetic acid; aqueous nitric acid / <40 / anschliessendes Behandeln mit Salpetersaeure <30grad

2: methanol; Na₂S₂

With methanol; sodium disulfide; nitric acid; acetic acid;

upstream raw materials:

4,5-dimethoxy-1,2-dinitrobenzene

1-bromo-4,5-dimethoxy-2-nitro-benzene

methanol

1,2-dimethoxybenzene

Downstream raw materials:

2-methyl-5,6-dimethoxy-1,3-benzothiazole

2-amino-4,5-dimethoxy-thiophenol

2-phenyl-benzothiazole-5,6-diol

5,6-dimethoxy-2-phenyl-1,3-benzothiazole