1-Phenyl-3,3-diethyltriazene

Base Information

• Chemical Name: 1-Phenyl-3,3-diethyltriazene
• CAS No.: 13056-98-9
• Molecular Formula: C10H15 N3
• Molecular Weight: 177.249
• Hs Code.: 2928000090
• NSC Number: 136059
• UNII: 6KCK8P2Q5G
• DSSTox Substance ID: DTXSID801030280
• Nikkaji Number: J36.528I
• Mol file: 13056-98-9.mol

Synonyms:1-(3-phenyl)-3,3-diethyltriazene;PHDAT

Chemical Property of 1-Phenyl-3,3-diethyltriazene

Chemical Property:

• Vapor Pressure: 0.036mmHg at 25°C
• Refractive Index: 1.6250 (estimate)
• Boiling Point: 241.4°Cat760mmHg
• Flash Point: 99.8°C
• PSA: 27.96000
• Density: 0.96g/cm³
• LogP: 3.02710
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 177.126597491
• Heavy Atom Count: 13
• Complexity: 146

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)N=NC1=CC=CC=C1

Technology Process of 1-Phenyl-3,3-diethyltriazene

There total 5 articles about 1-Phenyl-3,3-diethyltriazene 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: 83.0%

diethylamine (109-89-7) → 3,3-diethyl-1-phenyltriazene (13056-98-9)

Guidance literature:

In water; at 20 ℃; for 0.166667h;

DOI:10.1016/j.dyepig.2013.10.022

Reference yield: 73.0%

benzene diazonium chloride (100-34-5) + diethylamine (109-89-7) → 3,3-diethyl-1-phenyltriaz-1-ene (13056-98-9)

Guidance literature:

With sodium carbonate; In water; at 5 - 10 ℃; for 0.5h;

DOI:10.1135/cccc19940401

Reference yield:

diethylamine (109-89-7) + aniline (62-53-3) → 3,3-diethyl-1-phenyltriaz-1-ene (13056-98-9)

Guidance literature:

With hydrogenchloride; potassium carbonate; sodium nitrite; Multistep reaction; 1) H₂O, 0 degC, 30 min;

DOI:10.1021/jo00171a050

upstream raw materials:

benzene diazonium chloride

diethylamine

aniline

phenylmagnesium chloride

Downstream raw materials:

diphenylmethyl tert-butyl nitroxide

bromobenzene

iodobenzene

benzene