NISTC2101862

Base Information

• Chemical Name: NISTC2101862
• CAS No.: 2101-86-2
• Molecular Formula: C7H7N3
• Molecular Weight: 133.153
• Mol file: 2101-86-2.mol

Synonyms:p-tolyl azide;p-Tolyl azide solution;4-Methylphenyl azide solution;4-Azidotoluene solution;Benzene, 1-azido-4-methyl-;1-azido-4-methyl-benzene;Toluene,p-azido;p-azidotoluene;Benzene,1-azido-4-methyl;para-methyl phenyl azide;

Chemical Property of NISTC2101862

Chemical Property:

• Melting Point: -29°C
• Refractive Index: 1.5341 (estimate)
• Boiling Point: 235.67°C (rough estimate)
• Flash Point: -33℃
• PSA: 49.75000
• Density: 1.0527
• LogP: 2.38956
• Storage Temp.: ?20°C

Purity/Quality:

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

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

Safty Information:

• Pictogram(s): 1841411
• Hazard Codes: F,Xi
• Statements: 11-38
• Safety Statements: 16

MSDS Files:

Total 1 MSDS from other Authors

Useful:

• Uses: 4-Azidotoluene solution may be used for the functionalization at the axial position of boron subphthalocyanines with a terminal acetylene functionality via copper(I)-catalyzed azide-alkyne cycloaddition in the presence of Hunig′s base.

Technology Process of NISTC2101862

There total 41 articles about NISTC2101862 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%

p-toluidine (106-49-0,12221-03-3) → p-methylazidobenzene (2101-86-2)

Guidance literature:

With tert.-butylnitrite; trimethylsilylazide; In acetonitrile; at 0 - 20 ℃; for 2h;

DOI:10.1021/acs.jmedchem.1c01049

Reference yield: 95.0%

1-azido-2-iodo-4-methyl-benzene (122099-10-9) → p-methylazidobenzene (2101-86-2)

Guidance literature:

With hydrogen; triethylamine; 10percent Pd/C; In methanol; at 20 ℃; for 0.75h; under 760.051 Torr;

DOI:10.1021/jo0109669

Reference yield: 92.0%

4-methylphenylboronic acid (5720-05-8) → p-methylazidobenzene (2101-86-2)

Guidance literature:

With sodium azide; copper(II) sulfate; In methanol; at 20 ℃; for 14h;

DOI:10.1016/j.tetlet.2007.03.107

upstream raw materials:

methanesulfonamide

p-methylbenzenediazonium chloride

1-methyl-4-nitrosobenzene

p-tolyllead triacetate

Downstream raw materials:

4-methoxy-4-methylcyclohexa-2,5-dien-1-one

ethyl 5-amino-1-p-tolyl-1H-1,2,3-triazole-4-carboxylate

N-(p-tolyl)-P,P,P-triphenylphosphine imide

N-(4-hydroxyphenyl)-p-toluidine

Refernces

• 1、 Znati, Mansour,Debbabi, Meriem,Romdhane, Anis,Ben Jannet, Hichem,Bouajila, Jalloul. "Synthesis of new anticancer and anti-inflammatory isoxazolines and aziridines from the natural (-)-deltoin". . p. 1700 - 1712. Retrieved 2018.
• 2、 Gjonaj, Lorina,Roelfes, Gerard. "Selective chemical modification of DNA with alkoxy- and benzyloxyamines". . p. 6059 - 6065. Retrieved 2015.
• 3、 Masood, Mir Mohammad,Hasan, Phool,Tabrez, Shams,Ahmad, Md. Bilal,Yadava, Umesh,Daniliuc, Constantin G.,Sonawane, Yogesh A.,Azam, Amir,Rub, Abdur,Abid, Mohammad. "Anti-leishmanial and cytotoxic activities of amino acid-triazole hybrids: Synthesis, biological evaluation, molecular docking and in silico physico-chemical properties". . p. 1886 - 1891. Retrieved 2017.
• 4、 Abbaspour, M.,Mohammadi Ziarani, G.,Rafiee, F.. "Immobilization of vitamin B1 on the magnetic dialdehyde starch as an efficient carbene-type support for the copper complexation and its catalytic activity examination". . . Retrieved 2021/11/16.
• 5、 Praveenkumar,Gurrapu, Nirmala,Kolluri, Prashanth Kumar,Shivaraj,Subhashini,Dokala, Appaji. "Selective CDK4/6 inhibition of novel 1,2,3-triazole tethered acridinedione derivatives induces G1/S cell cycle transition arrest via Rb phosphorylation blockade in breast cancer models". . . Retrieved 2021/10/12.