1,2-Dinitrofluoranthene

Base Information

• Chemical Name: 1,2-Dinitrofluoranthene
• CAS No.: 33611-88-0
• Molecular Formula: C16H8 N2 O4
• Molecular Weight: 0
• Hs Code.: 2904209090
• DSSTox Substance ID: DTXSID10948803
• Nikkaji Number: J313.279J
• Wikidata: Q82926630
• ChEMBL ID: CHEMBL354241
• Mol file: 33611-88-0.mol

Synonyms:1,2-Dinitrofluoranthene;Dinitrofluoranthene;33611-88-0;Fluoranthene, 1,2-dinitro;CCRIS 4009;Fluoranthene, dinitro-;Fluoranthene, 1,2-dinitro-;BRN 2542255;1,2-Dinitro-fluoranthene;CHEMBL354241;DTXSID10948803;ZVFDFXXVLYCTIA-UHFFFAOYSA-N;25896-23-5

Chemical Property of 1,2-Dinitrofluoranthene

Chemical Property:

• Vapor Pressure: 1.63E-11mmHg at 25°C
• Boiling Point: 548.3°Cat760mmHg
• Flash Point: 282.4°C
• PSA: 91.64000
• Density: 1.574g/cm³
• LogP: 5.35000
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 292.04840674
• Heavy Atom Count: 22
• Complexity: 486

Purity/Quality:

1,2-DINITROFLUORANTHENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC4=CC(=C(C2=C43)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 1,2-Dinitrofluoranthene

There total 9 articles about 1,2-Dinitrofluoranthene 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: 58.0%

fluoranthene (206-44-0) → 3-nitrofluoranthene (892-21-7) + 1,2-dinitrofluoranthene (33611-88-0) + 2-nitrofluoranthene (13177-29-2) + 1,3-dinitrofluoranthene (110419-21-1)

Guidance literature:

With Nitrogen dioxide; In tetrachloromethane; at 24.5 - 25.5 ℃; Further byproducts given;

DOI:10.1021/jo00296a015

Reference yield: 30.0%

fluoranthene (206-44-0) → 1,2-dinitrofluoranthene (33611-88-0) + 2-nitrofluoranthene (13177-29-2) + 2-hydroxyfluoranthene (85923-82-6) + 10b-nitrato-1-nitro-1,2,3,10b-tatrahydrofluoranthene 2,3-oxide (102493-16-3)

Guidance literature:

With dinitrogen pentoxide; In chloroform; at 25 ℃; Further byproducts given;

DOI:10.1021/ja00274a045

Reference yield: 30.0%

fluoranthene (206-44-0) → 1,2-dinitrofluoranthene (33611-88-0) + 2-nitrofluoranthene (13177-29-2) + 2-hydroxy-1-nitrofluoranthene (102493-15-2) + 10b-nitrato-1-nitro-1,2,3,10b-tatrahydrofluoranthene 2,3-oxide (102493-16-3)

Guidance literature:

With dinitrogen pentoxide; In chloroform; at 25 ℃; Further byproducts given;

DOI:10.1021/ja00274a045

upstream raw materials:

2,3-Dihydrofluoranthene

fluoranthene

Refernces

• 1、 Squadrito, Giuseppe L.,Church, Daniel F.,Pryor, William A.. "Anomalous Nitration of Fluoranthene with Nitrogen Dioxide in Carbon Tetrachloride". . p. 6535 - 6537. Retrieved 2007/10/02.