1-(Azidomethyl)-4-chlorobenzene

Base Information

• Chemical Name: 1-(Azidomethyl)-4-chlorobenzene
• CAS No.: 27032-10-6
• Molecular Formula: C7H6ClN3
• Molecular Weight: 167.598
• Hs Code.: 2929909090
• European Community (EC) Number: 694-798-3
• DSSTox Substance ID: DTXSID60457531
• Nikkaji Number: J258.326G
• Mol file: 27032-10-6.mol

Synonyms:1-(azidomethyl)-4-chlorobenzene;27032-10-6;4-Chlorobenzyl azide;SCHEMBL13435556;DTXSID60457531;JMTPIENQTKMREN-UHFFFAOYSA-N;AKOS009452522;EN300-207143

Chemical Property of 1-(Azidomethyl)-4-chlorobenzene

Chemical Property:

• PSA: 49.75000
• LogP: 2.60306
• Storage Temp.: 2-8°C
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 167.0250249
• Heavy Atom Count: 11
• Complexity: 157

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-(azidomethyl)-4-chlorobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 2441922
• Hazard Codes: Xn
• Statements: 40-48/20/21/22
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CN=[N+]=[N-])Cl

Technology Process of 1-(Azidomethyl)-4-chlorobenzene

There total 16 articles about 1-(Azidomethyl)-4-chlorobenzene 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: 100.0%

1-Chloro-4-(chloromethyl)benzene (104-83-6) → 4-chlorobenzyl azide (27032-10-6)

Guidance literature:

With sodium azide; In water; at 80 ℃; for 4h;

DOI:10.1021/acs.inorgchem.7b01025

Reference yield: 100.0%

4-chlorobenzyl bromide (622-95-7) → 4-chlorobenzyl azide (27032-10-6)

Guidance literature:

With sodium azide; In dimethyl sulfoxide; at 80 ℃;

DOI:10.1021/acs.orglett.7b03123

Reference yield: 97.0%

para-Chlorobenzyl alcohol (873-76-7) → 4-chlorobenzyl azide (27032-10-6)

Guidance literature:

With tetrabutylammoniun azide; triphenylphosphine; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In dichloromethane; at 20 ℃; for 0.666667h;

DOI:10.1016/j.tetlet.2004.02.141

upstream raw materials:

1-Chloro-4-(chloromethyl)benzene

4-chlorobenzyl bromide

1-(p-Chlorbenzyl)-3-cyanpyridiniumchlorid

para-Chlorobenzyl alcohol

Downstream raw materials:

(2R,3R,4R,5R)-2-(acetoxymethyl)-5-(6-(1-(4-chlorobenzyl)-1H-1,2,3-triazol-4-yl)-9H-purin-9-yl)tetrahydrofuran-3,4-diyl diacetate

6-chloroquinoline-3-carboxylic acid ethyl ester

7-chloro-quinoline-3-carboxylic acid ethyl ester

5-chloroquinoline-3-carboxylic acid ethyl ester