4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline

Base Information

• Chemical Name: 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline
• CAS No.: 14544-47-9
• Molecular Formula: C21H18 N6
• Molecular Weight: 354.414
• Hs Code.: 2933699090
• European Community (EC) Number: 835-620-8
• DSSTox Substance ID: DTXSID40363924
• Nikkaji Number: J2.252.865C
• Wikidata: Q82147671
• Mol file: 14544-47-9.mol

Synonyms:2,4,6-tris(4-aminophenyl)-1,3,5-triazine

Chemical Property of 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline

Chemical Property:

• Vapor Pressure: 9.77E-20mmHg at 25°C
• Melting Point: 380-382℃
• Boiling Point: 705.2°C at 760 mmHg
• PKA: 3.68±0.10(Predicted)
• Flash Point: 419.8°C
• PSA: 116.73000
• Density: 1.303g/cm³
• LogP: 5.36280
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 354.15929460
• Heavy Atom Count: 27
• Complexity: 371

Purity/Quality:

99% ^*data from raw suppliers

4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=NC(=NC(=N2)C3=CC=C(C=C3)N)C4=CC=C(C=C4)N)N

Technology Process of 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline

There total 5 articles about 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)trianiline 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: 95.0%

4-Aminobenzonitrile (873-74-5) → 4,4',4-(1,3,5‐triazine‐2,4,6‐triyl)trianiline (14544-47-9)

Guidance literature:

at 0 - 20 ℃; for 18h; Acidic conditions;

DOI:10.1039/c8ta04611e

Reference yield: 85.0%

C21H18N6*3CHF3O3S → 4,4',4-(1,3,5‐triazine‐2,4,6‐triyl)trianiline (14544-47-9)

Guidance literature:

With water; sodium hydroxide; pH=9 - 11;

Reference yield: 56.8%

2,4,6-tris(4-nitrophenyl)-1,3,5-triazine (13960-34-4) → 4,4',4-(1,3,5‐triazine‐2,4,6‐triyl)trianiline (14544-47-9)

Guidance literature:

With 5%-palladium/activated carbon; hydrazine hydrate; In 1,4-dioxane; ethanol; for 24h; Inert atmosphere; Reflux;

DOI:10.1002/anie.201600087

upstream raw materials:

2,4,6-tris(4-nitrophenyl)-1,3,5-triazine

2,4,6-tris(4-bromophenyl)-1,3,5-triazine

4-Aminobenzonitrile

((1,3,5-triazine-2,4,6-triyl)tris(benzene-4,1-diyl))triacetamide

Downstream raw materials:

C₄₂H₃₉Cl₆N₁₅

2,4,6-tri(4-n-butylaminophenyl)-1,3,5-triazine

C₄₂H₄₂Cl₃N₁₅O₃

C₄₂H₃₆N₆O₆S₃

Refernces

• 1、 Bai, Linyi,Phua, Soo Zeng Fiona,Lim, Wei Qi,Jana, Avijit,Luo, Zhong,Tham, Huijun Phoebe,Zhao, Lingzhi,Gao, Qiang,Zhao, Yanli. "Nanoscale covalent organic frameworks as smart carriers for drug delivery". . p. 4128 - 4131. Retrieved 2016.
• 2、 Dutta, Tapas Kumar,Patra, Abhijit. "Post-synthetic Modification of Covalent Organic Frameworks through in situ Polymerization of Aniline for Enhanced Capacitive Energy Storage". . p. 158 - 164. Retrieved 2021.
• 3、 Gomes, Ruth,Bhanja, Piyali,Bhaumik, Asim. "A triazine-based covalent organic polymer for efficient CO2 adsorption". . p. 10050 - 10053. Retrieved 2015.
• 4、 Wu, Xingchun,Wang, Bowei,Yang, Ziqi,Chen, Ligong. "Novel imine-linked covalent organic frameworks: Preparation, characterization and application". . p. 5650 - 5655. Retrieved 2019.
• 5、 Li, Yuntong,Liu, Ling,Wu, Yuzhe,Wu, Tong,Wu, Haiyang,Cai, Qipeng,Xu, Yiting,Zeng, Birong,Yuan, Conghui,Dai, Lizong. "Facile synthesis of nitrogen-doped carbon materials with hierarchical porous structures for high-performance supercapacitors in both acidic and alkaline electrolytes". . p. 13154 - 13163. Retrieved 2019.
• 6、 Li, Zonglong,Sheng, Li,Wang, Hangchao,Wang, Xiaolin,Li, Mingyang,Xu, Yulong,Cui, Hao,Zhang, Haitian,Liang, Hongmei,Xu, Hong,He, Xiangming. "Three-Dimensional Covalent Organic Framework with ceq Topology". . p. 92 - 96. Retrieved 2021.
• 7、 Bhanja, Piyali,Bhunia, Kousik,Das, Sabuj K.,Pradhan, Debabrata,Kimura, Ryuto,Hijikata, Yuh,Irle, Stephan,Bhaumik, Asim. "A New Triazine-Based Covalent Organic Framework for High-Performance Capacitive Energy Storage". . p. 921 - 929. Retrieved 2017.
• 8、 Li, Hai-Yan,Li, Hong-Xi,Tian, Xin-Xin,Wang, Jixian,Wang, Wen-Bao,Young, David J.,Yu, Lei. "Engineering structural defects into a covalent organic framework for enhanced photocatalytic activity". supporting information. p. 25474 - 25479. Retrieved 2021/12/07.