Triazene, 1-(p-bromophenyl)-3-methyl-

Base Information

• Chemical Name: Triazene, 1-(p-bromophenyl)-3-methyl-
• CAS No.: 40643-36-5
• Molecular Formula: C7H8BrN3
• Molecular Weight: 214.065
• DSSTox Substance ID: DTXSID20193645
• Nikkaji Number: J48.088F
• ChEMBL ID: CHEMBL4847030
• Mol file: 40643-36-5.mol

Synonyms:40643-36-5;Triazene, 1-(p-bromophenyl)-3-methyl-;BRN 1841429;1-(p-Bromophenyl)-3-methyltriazene;1-(4-Bromophenyl)-3-methyltriazene;4-16-00-00910 (Beilstein Handbook Reference);CHEMBL4847030;DTXSID20193645

Chemical Property of Triazene, 1-(p-bromophenyl)-3-methyl-

Chemical Property:

• Vapor Pressure: 0.0246mmHg at 25°C
• Boiling Point: 248.1°C at 760 mmHg
• Flash Point: 103.9°C
• PSA: 36.75000
• Density: 1.5g/cm³
• LogP: 2.93100
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 212.99016
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN=NNC1=CC=C(C=C1)Br

Technology Process of Triazene, 1-(p-bromophenyl)-3-methyl-

There total 11 articles about Triazene, 1-(p-bromophenyl)-3-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: 84.0%

1-p-bromophenyl-3-hydroxymethyl-3-methyltriazene (73779-15-4) + methylamine (74-89-5) → 1-p-bromophenyl-3-methyltriazene (40643-36-5)

Guidance literature:

In water; for 48h; Ambient temperature;

Reference yield:

C13H15BrN4O5 (1407791-35-8) → L-glutamic acid (56-86-0,21675-62-7,23009-64-5,25104-13-6,84960-48-5,25513-46-6) + 1-(4-bromophenyl)-3-methyltriazene (40643-36-5)

Guidance literature:

With Pseudomonas sp. E_.C_. 3.4.17.11 carboxypeptidase G₂; In aq. buffer; at 30 ℃; pH=7.3; Kinetics; Enzymatic reaction;

DOI:10.1016/j.bmcl.2012.09.029

Reference yield:

ethanol (64-17-5) + 1-(4-bromophenyl)-3-formyl-3-methyltriazene (76935-83-6) → 1-(4-bromophenyl)-3-methyltriazene (40643-36-5) + formic acid ethyl ester (109-94-4)

Guidance literature:

With piperidine; at 25 ℃; Rate constant; Mechanism;

upstream raw materials:

methyl magnesium iodide

1-azido-4-bromobenzene

(4-bromophenyl)diazonium chloride

methylamine

Downstream raw materials:

4-bromo-aniline

benzeneacetic acid methyl ester

ethyl methyl ether

3-(2-(acetylamino)propanoyl)-1-(4-bromophenyl)-3-methyltriazene