Benzene, 3-methyl-1,2,4,5-tetranitro-

Base Information

Chemical Name:Benzene, 3-methyl-1,2,4,5-tetranitro-
CAS No.:102367-91-9
Molecular Formula:C₇H₄N₄O₈
Molecular Weight:272.131
Hs Code.:
DSSTox Substance ID:DTXSID40450585
Nikkaji Number:J584.497E
Wikidata:Q82270372
Mol file:102367-91-9.mol

Synonyms:Benzene, 3-methyl-1,2,4,5-tetranitro-;102367-91-9;2,3,5,6-Tetranitrotoluene;DTXSID40450585

Suppliers and Price of Benzene, 3-methyl-1,2,4,5-tetranitro-

Supply Marketing:

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

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Chemical Property of Benzene, 3-methyl-1,2,4,5-tetranitro-

Chemical Property:

XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:0
Exact Mass:272.00291310
Heavy Atom Count:19
Complexity:379

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Technology Process of Benzene, 3-methyl-1,2,4,5-tetranitro-

There total 4 articles about Benzene, 3-methyl-1,2,4,5-tetranitro- 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:

: 84432-54-2
4-amino-N,2,3,5,6-pentanitrotoluene

: 84432-53-1
4-Amino-2,3,5,6-tetranitrotoluene

: 102367-91-9
2,3,5,6-tetranitrotoluene

Guidance literature:: In ethyl acetate; for 60h; Heating;
DOI:10.1021/jo00363a032

Reference yield:

: 84432-53-1
4-Amino-2,3,5,6-tetranitrotoluene

: 102367-91-9
2,3,5,6-tetranitrotoluene

Guidance literature:: With nitrosylsulfuric acid; sulfuric acid; hypophosphorous acid; Yield given. Multistep reaction; 1.) 25 deg C, 24 h, 2.) 25 deg C, 16 h; 50 deg C, 1 h; 25 deg C, 3 h;
DOI:10.1021/jo00086a020

Reference yield:

: 19406-51-0,153919-64-3
4-Amino-2,6-dinitrotoluene

: 102367-91-9
2,3,5,6-tetranitrotoluene

Guidance literature:: Multi-step reaction with 3 steps

1: conc. H₂SO₄, 90percent HNO₃ / 3 h / 25 °C

2: 75 percent / conc. H₂SO₄, anisole / 0.75 h / 0 - 5 °C

3: 1.) nitrosylsulfuric acid, conc. H₂SO₄, 2.) 50percent aq. H₃PO₂ / 1.) 25 deg C, 24 h, 2.) 25 deg C, 16 h; 50 deg C, 1 h; 25 deg C, 3 h

With nitrosylsulfuric acid; sulfuric acid; nitric acid; hypophosphorous acid; methoxybenzene;
DOI:10.1021/jo00086a020