1-AZIDO-4-BROMOBENZENE

Base Information

• Chemical Name: 1-AZIDO-4-BROMOBENZENE
• CAS No.: 2101-88-4
• Molecular Formula: C6H4BrN3
• Molecular Weight: 198.022
• Hs Code.: 2929909090
• European Community (EC) Number: 663-402-0
• DSSTox Substance ID: DTXSID10175218
• Nikkaji Number: J80.388J
• Wikidata: Q69756977
• ChEMBL ID: CHEMBL3236178
• Mol file: 2101-88-4.mol

Synonyms:p-Bromophenyl azide;4-bromo-1-azidobenzene;Benzene, 1-azido-4-bromo-;4-Bromophenyl azide;4-Bromophenyl azide solution;Benzene,1-azido-4-bromo;4-azido-1-bromobenzene;1-azido-4-bromo-benzene;

Chemical Property of 1-AZIDO-4-BROMOBENZENE

Chemical Property:

• Melting Point: 20°C
• Refractive Index: 1.6400 (estimate)
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 49.75000
• Density: g/cm³
• LogP: 2.84366
• Storage Temp.: ?20°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 196.95886
• Heavy Atom Count: 10
• Complexity: 145

Purity/Quality:

98%Min ^*data from raw suppliers

1-Azido-4-bromobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 1939308
• Hazard Codes: F,T
• Statements: 11-38-48/23/24/25
• Safety Statements: 16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=CC=C1N=[N+]=[N-])Br

Technology Process of 1-AZIDO-4-BROMOBENZENE

There total 33 articles about 1-AZIDO-4-BROMOBENZENE 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: 98.0%

4-bromo-aniline (106-40-1) → 1-azido-4-bromobenzene (2101-88-4)

Guidance literature:

4-bromo-aniline; With hydrogenchloride; In water; at 0 - 5 ℃; for 0.5h;

With sodium azide; sodium nitrite; In water; at 0 - 5 ℃; for 1h;

DOI:10.1002/cmdc.201100265

Reference yield: 93.4%

4-Bromophenylboronic acid (5467-74-3) → 1-azido-4-bromobenzene (2101-88-4)

Guidance literature:

With sodium azide; copper diacetate; In methanol; at 20 ℃; for 23h;

Reference yield: 92.0%

sodium azide + 4-bromo-aniline (106-40-1) → 1-azido-4-bromobenzene (2101-88-4)

Guidance literature:

4-bromo-aniline; With hydrogenchloride; sodium nitrite; In water; at 0 ℃; for 0.166667h;

sodium azide; In water; at 0 - 20 ℃; for 1h;

DOI:10.1021/ic302798u

upstream raw materials:

formic acid-[N'-(4-bromo-phenyl)-N'-nitroso-hydrazide]

(4-bromophenyl)diazonium chloride

(4-bromophenyl)hydrazine

1-(p)-Bromophenyl-3-formyl-triazene

Downstream raw materials:

bis-[3-(4-bromo-phenyl)-triazenyl]-acetylene

N-(4-bromo-phenyl)-N'-[1-(4-bromo-phenyl)-1H-[1,2,3]triazol-4-yl]-triazene

1-(4-bromophenyl)-3-methyltriazene

2,4-dibromo-aniline

Refernces

• 1、 Choua?b, Karim,Delemasure, Stéphanie,Dutartre, Patrick,Jannet, Hichem Ben. "Microwave-assisted synthesis, anti-inflammatory and anti-proliferative activities of new maslinic acid derivatives bearing 1,5- and 1,4-disubstituted triazoles". . p. 130 - 147. Retrieved 2016.
• 2、 Wang, Zi-Cheng,Li, Xiao-Zhen,Liu, Jia-Hui,Zhou, Li-Peng,Guo, Xiao-Qing,Cheng, Xiu-Yan,Sun, Qing-Fu. "Coordination-Assembly of Lanthanide Supramolecular Hydrogels with Luminescent Multi-stimulus Response". supporting information. p. 18192 - 18198. Retrieved 2021/11/23.
• 3、 Viegas, Daiane J.,da Silva, Ver?nica D.,Buarque, Camilla D.,Bloom, David C.,Abreu, Paula A.. "Antiviral activity of 1,4-disubstituted-1,2,3-triazoles against HSV-1 in vitro". . p. 399 - 410. Retrieved 2021/05/31.