ALD00554

5-phenyl-1,2,3-triazine

≥95%

• Empirical Formula (Hill Notation): C₉H₇N₃
• CAS Number: 106636-96-8
• Molecular Weight: 157.17
• UNSPSC Code: 12352200
• PubChem Substance ID: 329772716
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: ≥95%
• form: flakes
• mp: 141-146 °C
• storage temp.: −20°C
• SMILES string: C1(C2=CC=CC=C2)=CN=NN=C1
• InChI: 1S/C9H7N3/c1-2-4-8(5-3-1)9-6-10-12-11-7-9/h1-7H
• InChI key: KJZQIXWSZPPOHO-UHFFFAOYSA-N

Description

General description

5-Phenyl-1,2,3-triazine is a phenyl triazine derivative. 5-phenyl-1,2,3-triazine exhibits electronic and nonlinear optical properties. 5-Phenyl-1,2,3-triazine can be prepared from 4-bromopyrazole. It undergoes Diels-Alder reaction with ketene acetal.

Application

The following 1,2,3-triazine was reported by Boger and coworkers to undergo an Inverse Electron Demand Diels-Alder with electron rich dienophiles to afford nitrogen-containing heterocycles, more specifically pyrimidines and novel-substituted pyridines.

Other Notes

Inverse Electron Demand Diels–Alder Reactions of 1,2,3-Triazines: Pronounced Substituent Effects on Reactivity and Cycloaddition Scope

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable