1-phenyl-1H-1,2,3-triazole-5-carbaldehyde

Base Information

• Chemical Name: 1-phenyl-1H-1,2,3-triazole-5-carbaldehyde
• CAS No.: 59401-82-0
• Molecular Formula: C₉H₇N₃O
• Molecular Weight: 173.174
• European Community (EC) Number: 853-344-6

Synonyms:1-phenyl-1H-1,2,3-triazole-5-carbaldehyde;59401-82-0;3-phenyltriazole-4-carbaldehyde;AKOS022623947;EN300-189231;Z1416196545

Chemical Property of 1-phenyl-1H-1,2,3-triazole-5-carbaldehyde

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 173.058911855
• Heavy Atom Count: 13
• Complexity: 180

Purity/Quality:

99% ^*data from raw suppliers

1-phenyl-1H-1,2,3-triazole-5-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N2C(=CN=N2)C=O

Technology Process of 1-phenyl-1H-1,2,3-triazole-5-carbaldehyde

There total 7 articles about 1-phenyl-1H-1,2,3-triazole-5-carbaldehyde 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: 66.0%

(3-Phenyl-3H-[1,2,3]triazol-4-yl)-triphenylsilanyl-methanone → 1-phenyl-1,2,3-triazole-5-carbaldehyde (59401-82-0)

Guidance literature:

With sodium hydroxide; In ethanol; for 0.0833333h; Ambient temperature;

DOI:10.1016/0040-4039(95)01904-V

Reference yield: 63.0%

5-(methoxymethyl)-1-phenyl-1H-[1,2,3]-triazole (133902-71-3) → 1-phenyl-1,2,3-triazole-5-carbaldehyde (59401-82-0)

Guidance literature:

With N-Bromosuccinimide; dibenzoyl peroxide; In tetrachloromethane; Heating;

Reference yield:

Phenyl azide (622-37-7) → 1-phenyl-1,2,3-triazole-4-carbaldehyde (34296-51-0) + 1-phenyl-1,2,3-triazole-5-carbaldehyde (59401-82-0)

Guidance literature:

With toluene; Erwaermen des Reaktionsprodukts mit wss.aethanol.H₂SO₄;

DOI:10.1021/ja01147a098

upstream raw materials:

5-(methoxymethyl)-1-phenyl-1H-[1,2,3]-triazole

Phenyl azide

5-(methoxymethyl)-1-phenyl-1H-1,2,3-triazole-4-carboxylic acid

4-methoxycarbonyl-5-methoxymethyl-1-phenyl-1,2,3-triazole

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