1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl-

Base Information

• Chemical Name: 1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl-
• CAS No.: 103596-73-2
• Molecular Formula: C₁₅H₂₆N₂
• Molecular Weight: 234.385
• DSSTox Substance ID: DTXSID2073017
• Nikkaji Number: J1.551.567H
• Wikidata: Q82001378
• Mol file: 103596-73-2.mol

Synonyms:3,5-Di-tert-butyl-2,6-toluenediamine;1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl-;103596-73-2;SCHEMBL9835185;DTXSID2073017;4,6-Bis(1,1-dimethylethyl)-2-methyl-1,3-benzenediamine

Chemical Property of 1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl-

Chemical Property:

• Vapor Pressure: 0.000123mmHg at 25°C
• Boiling Point: 335.1°Cat760mmHg
• Flash Point: 186°C
• Density: 0.961g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 234.209598838
• Heavy Atom Count: 17
• Complexity: 233

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC(=C1N)C(C)(C)C)C(C)(C)C)N

Technology Process of 1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl-

There total 3 articles about 1,3-Benzenediamine, 4,6-bis(1,1-dimethylethyl)-2-methyl- 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:

1,5-di-tert-butyl-3-methyl-2,4-dinitro-benzene (101354-77-2) → 4,6-di-tert-butyl-2-methyl-m-phenylenediamine (103596-73-2)

Guidance literature:

With ethanol; nickel; at 60 ℃; Hydrogenation;

Reference yield:

3, 5-di-tert-butyltoluene (15181-11-0) → 4,6-di-tert-butyl-2-methyl-m-phenylenediamine (103596-73-2)

Guidance literature:

Multi-step reaction with 2 steps

1: concentrated sulfuric acid; nitric acid

2: Raney nickel; ethanol / 60 °C / Hydrogenation

With ethanol; sulfuric acid; nitric acid; nickel;

Reference yield:

toluene (108-88-3,15644-74-3,16713-13-6) → 4,6-di-tert-butyl-2-methyl-m-phenylenediamine (103596-73-2)

Guidance literature:

Multi-step reaction with 3 steps

1: aluminium chloride

2: concentrated sulfuric acid; nitric acid

3: Raney nickel; ethanol / 60 °C / Hydrogenation

With aluminium trichloride; ethanol; sulfuric acid; nitric acid; nickel;

upstream raw materials:

1,5-di-tert-butyl-3-methyl-2,4-dinitro-benzene

3, 5-di-tert-butyltoluene

toluene