3,3-Dimethyl-1-(3-nitrophenyl)triazene

Base Information

• Chemical Name: 3,3-Dimethyl-1-(3-nitrophenyl)triazene
• CAS No.: 20241-06-9
• Molecular Formula: C8H10N4O2
• Molecular Weight: 194.193
• Hs Code.: 2928000090
• European Community (EC) Number: 633-841-2
• NSC Number: 82309
• UNII: 4H669UW747
• DSSTox Substance ID: DTXSID80879150
• Nikkaji Number: J48.094K
• ChEMBL ID: CHEMBL3251108
• Mol file: 20241-06-9.mol

Synonyms:3,3-Dimethyl-1-(3-nitrophenyl)triazene;20241-06-9;N-methyl-N-[(3-nitrophenyl)diazenyl]methanamine;1-(m-Nitrophenyl)-3,3-dimethyltriazine;1-(3-Nitrophenyl)-3,3-dimethyltriazene;(1E)-3,3-dimethyl-1-(3-nitrophenyl)-1-triazene;Triazene, 3,3-dimethyl-1-(m-nitrophenyl)-;1-Triazene, 3,3-dimethyl-1-(3-nitrophenyl)-;NSC-82309;NSC 82309;BRN 1842048;3,3-Dimethyl-1-(m-nitrophenyl)triazene;NSC82309;3,3-dimethyl-1-(3-nitrophenyl)triaz-1-ene;4-16-00-00911 (Beilstein Handbook Reference);SCHEMBL1304458;CHEMBL3251108;DTXSID80879150;3,3-Dimethyl-1-m-nitrophenyltriazen;AKOS006372892;AKOS015917363;AKOS024332387;4H669UW747;Triazene,3-dimethyl-1-(m-nitrophenyl)-;N-methyl-N-(3-nitrophenyl)azomethanamine;1-Triazene,3-dimethyl-1-(3-nitrophenyl)-;FT-0659844;1-(3-NO2 PH)-3,3-DIMETHYLTRIAZENE;N-methyl-N-(3-nitrophenyl)diazenylmethanamine;A814354;1-Triazene, 3,3-dimethyl-1-(3-nitrophenyl)-, (1E)-;1087706-99-7

Chemical Property of 3,3-Dimethyl-1-(3-nitrophenyl)triazene

Chemical Property:

• Vapor Pressure: 0.0022mmHg at 25°C
• Boiling Point: 289.5°C at 760 mmHg
• Flash Point: 128.9°C
• PSA: 73.78000
• Density: 1.23g/cm³
• LogP: 2.67830
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 194.08037557
• Heavy Atom Count: 14
• Complexity: 224

Purity/Quality:

99%min ^*data from raw suppliers

3,3-Dimethyl-1-(m-nitrophenyl)-triazene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)N=NC1=CC(=CC=C1)[N+](=O)[O-]
• Uses: 3,3-Dimethyl-1-(m-nitrophenyl)-triazene can be used as an antimalarial nematocide.

Technology Process of 3,3-Dimethyl-1-(3-nitrophenyl)triazene

There total 5 articles about 3,3-Dimethyl-1-(3-nitrophenyl)triazene 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: 44.0%

dimethyl amine (124-40-3) + 3-nitro-aniline (99-09-2) → 1-(3-nitrophenyl)-3,3-dimethyltriazene (20241-06-9)

Guidance literature:

3-nitro-aniline; With hydrogenchloride; sodium nitrite; at 0 - 10 ℃;

dimethyl amine; In water; cooling;

Reference yield:

3-nitro-aniline (99-09-2) → 1-(3-nitrophenyl)-3,3-dimethyltriazene (20241-06-9)

Guidance literature:

Multi-step reaction with 2 steps

1: NO₂ / 6 h / 0 °C

2: 0 °C

With Nitrogen dioxide;

DOI:10.1002/prac.19973390145

Reference yield:

dimethyl amine (124-40-3) + m-nitrobenzene diazonium nitrate → 1-(3-nitrophenyl)-3,3-dimethyltriazene (20241-06-9)

Guidance literature:

at 0 ℃; Yield given;

DOI:10.1002/prac.19973390145

upstream raw materials:

4-nitrobenzenediazonium chloride

dimethyl amine

3-nitro-aniline

Downstream raw materials:

3-nitro-1,1'-biphenyl

3‐(2‐methylphenyl)aniline

3-nitro-2'-methylbiphenyl

Refernces

• 1、 Manolov, Ilia,Machulla,Momekov. "Synthesis, physicochemical characterization and preliminary pharmacological in vitro evaluation of two novel cytotoxic benzophenone-linked 3,3-dimethyltriazenes". . p. 511 - 516. Retrieved 2007/10/03.