2-NITROMESITYLENE

Base Information Edit

Chemical Name:2-NITROMESITYLENE
CAS No.:603-71-4
Molecular Formula:C9H11 N O2
Molecular Weight:165.192
Hs Code.:2904209090
European Community (EC) Number:210-054-9
NSC Number:5413
UNII:AKZ2NK5ME7
DSSTox Substance ID:DTXSID8060533
Nikkaji Number:J38.257D
Wikidata:Q81989115
Mol file:603-71-4.mol

Synonyms:Mesitylene,2-nitro- (6CI,8CI); 1,3,5-Trimethyl-2-nitrobenzene;1-Nitro-2,4,6-trimethylbenzene; 2,4,6-Trimethyl-1-nitrobenzene;2,4,6-Trimethylnitrobenzene; 2-Nitro-1,3,5-trimethylbenzene; 2-Nitromesitylene;3,5-Dimethyl-4-nitrotoluene; Mononitromesitylene; NSC 5413; Nitromesitylene

Suppliers and Price of 2-NITROMESITYLENE

Supply Marketing:Edit

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

American Custom Chemicals Corporation
2-NITRO MESITYLENE 95.00%
10G
$ 1143.87

AHH
2-Nitromesitylene 99%
500g
$ 328.00

Total 20 raw suppliers

Chemical Property of 2-NITROMESITYLENE Edit

Chemical Property:

Vapor Pressure:0.0241mmHg at 25°C
Melting Point:41-44 °C(lit.)
Refractive Index:1.5278 (estimate)
Boiling Point:255 °C(lit.)
Flash Point:187 °F
PSA：45.82000
Density:1.1g/cm³
LogP:3.04320
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:165.078978594
Heavy Atom Count:12
Complexity:164

Purity/Quality:

99% ^*data from raw suppliers

2-NITRO MESITYLENE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): F,Xn
Hazard Codes:F,Xn
Statements: 11-20/21/22-36/37/38
Safety Statements: 16-26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC1=CC(=C(C(=C1)C)[N+](=O)[O-])C
Uses 2-Nitromesitylene is a substituted nitrobenzene derivative used in medicine and functional healthy food, pharmaceutical compounds comprising substituted nitrobenzene derivatives for prevention and?/or treatment of various diseases.

Technology Process of 2-NITROMESITYLENE

There total 32 articles about 2-NITROMESITYLENE 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: 100.0%

: 108-67-8
1,3,5-trimethyl-benzene

: 603-71-4,34505-32-3,82795-90-2
nitromesitylene

Guidance literature:: With dinitrogen tetraoxide; In dichloromethane; at -78 ℃; for 3h; Irradiation;
DOI:10.1021/jo00091a018

Reference yield: 94.15%

: 108-67-8
1,3,5-trimethyl-benzene

: 603-71-4,34505-32-3,82795-90-2
nitromesitylene

: 1,3,5-Trimethyl-2-nitro-4-nitrooxymethyl-benzene

: C₁₉H₂₂N₂O₄

Guidance literature:: With nitric acid; sodium nitrite; In water; trifluoroacetic acid; at 25 ℃; for 0.4h;
DOI:10.1039/P29840001659

Reference yield: 94.14%

: 108-67-8
1,3,5-trimethyl-benzene

: 603-71-4,34505-32-3,82795-90-2
nitromesitylene

: 1,3,5-Trimethyl-2-nitro-4-nitrooxymethyl-benzene

: 2-(3,5-Dimethyl-4-nitro-benzyl)-1,3,4-trimethyl-5-nitro-benzene

: C₁₉H₂₂N₂O₄

Guidance literature:: With nitric acid; sodium nitrite; In water; trifluoroacetic acid; at 24 ℃; for 0.4h; Rate constant; Mechanism; Product distribution; by application of lH n.m.r. spectroscopy: kinetic studies concerning the nitration of mesitylene; investigation of the influence of additives on the reaction rate; mechanism is proposed;
DOI:10.1039/P29840001659