N-PHENYLBENZOTRIAZOLEMETHANAMINE

Base Information

• Chemical Name: N-PHENYLBENZOTRIAZOLEMETHANAMINE
• CAS No.: 62001-29-0
• Molecular Formula: C13H12N4
• Molecular Weight: 224.265
• Hs Code.: 2933990090
• Mol file: 62001-29-0.mol

Synonyms:N-PHENYLBENZOTRIAZOLEMETHANAMINE, MIXTUR E OF BT1 AND BT2 ISOMERS

Chemical Property of N-PHENYLBENZOTRIAZOLEMETHANAMINE

Chemical Property:

• Melting Point: 137-143 °C(lit.)
• PSA: 42.74000
• LogP: 2.57390

Purity/Quality:

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

N-(1H-benzotriazol-1-ylmethyl)aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of N-PHENYLBENZOTRIAZOLEMETHANAMINE

There total 4 articles about N-PHENYLBENZOTRIAZOLEMETHANAMINE 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: 90.0%

1,2,3-Benzotriazole (95-14-7,27556-51-0) + formaldehyd (50-00-0,30525-89-4,61233-19-0) + aniline (62-53-3) → N-phenyl-1H-benzotriazolyl-1-methanamine (62001-29-0)

Guidance literature:

In methanol; at 20 ℃; for 2h;

DOI:10.1002/cjoc.201300443

Reference yield: 83.0%

1-Hydroxymethyl-1H-benzotriazole (28539-02-8) + aniline (62-53-3) → N-phenyl-1H-benzotriazolyl-1-methanamine (62001-29-0)

Guidance literature:

In ethanol; Heating;

Reference yield: 34.0%

1,2,3-Benzotriazole (95-14-7,27556-51-0) + aniline (62-53-3) → N-phenyl-1H-benzotriazolyl-1-methanamine (62001-29-0)

Guidance literature:

With formaldehyd; In ethanol; water; at 20 ℃; for 2h; Inert atmosphere; Schlenk technique; Sealed tube;

DOI:10.1002/chem.202003223

upstream raw materials:

1,2,3-Benzotriazole

formaldehyd

aniline

1-Hydroxymethyl-1H-benzotriazole

Downstream raw materials:

N-pentylaniline

1,2,3-Benzotriazole

2-[(phenylamino)methyl]cyclohexanone

1,7,7-trimethyl-3-(phenylaminomethyl)-bicyclo(2.2.1)heptan-2-one

Refernces

• 1、 Warsitz, Michael,Doye, Sven. "Linear Hydroaminoalkylation Products from Alkyl-Substituted Alkenes". supporting information. p. 15121 - 15125. Retrieved 2020/10/23.
• 2、 Yuan, Jun,Zhong, Ye,Li, Shiliang,Zhao, Xue,Luan, Guoqin,Zhao, Zhenjiang,Huang, Jin,Li, Honglin,Xu, Yufang. "Triazole and benzotriazole derivatives as novel inhibitors for p90 ribosomal S6 protein kinase 2: Synthesis, molecular docking and SAR analysis". . p. 1192 - 1198. Retrieved 2013/10/21.