54698-60-1

Basic information

• Product Name: 1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID
• Synonyms: AKOS BC-0323;1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID;1-Benzyl-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid 97%;1H-1,2,3-triazole-4-carboxylic acid, 5-methyl-1-(phenylmet;methyl 1-benzyl-5-methyl-1H-1,2,3-triazole-4-carboxylate;1-Benzyl-4-carboxy-5-methyl-1H-1,2,3-triazole;1-Benzyl-4-carboxy-5-methyl-1H-1,2,3-triazole, [(4-Carboxy-5-methyl-1h-1,2,3-triazol-1-yl)methyl]benzene;1-Benzyl-5-methyl-1H-1,2,3-triazole-4-carboxylicacid97%
• CAS NO: 54698-60-1
• Molecular Formula: C₁₁H₁₁N₃O₂
• Molecular Weight: 217.22
• Product Categories: Carboxylic Acids;Pyrazoles & Triazoles;Carboxylic Acids;Pyrazoles & Triazoles
• Mol File: 54698-60-1.mol
• Article Data: 9

Chemical Properties

• Melting Point: 170 °C
• Boiling Point: 455 °C at 760 mmHg
• Flash Point: 228.9 °C
• Appearance: /
• Density: 1.3 g/cm³
• Vapor Pressure: 4.55E-09mmHg at 25°C
• Refractive Index: 1.636
• CAS DataBase Reference: 1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID(54698-60-1)
• EPA Substance Registry System: 1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID(54698-60-1)

Safety Data

• Hazard Codes: F,Xn
• Statements: 22
• HazardClass: IRRITANT
• Hazardous Substances Data: 54698-60-1(Hazardous Substances Data)

Usage

Uses

1-Benzyl-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid is a triazole related compound with potential antifungal activity.

InChI:InChI=1/C11H11N3O2/c1-8-10(11(15)16)12-13-14(8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,15,16)

Upstream product

• 590-93-2 2-Butynoic acid 
• 622-79-7 benzyl azide 
• 664351-09-1 1-benzyl-5-methyl-1H-1,2,3-triazol-4-carbonyl chloride 
• 100-39-0 benzyl bromide 
• 133992-58-2 1-benzyl-5-methyl-1H-1,2,3-triazol-4-carboxylic acid ethyl ester 

Downstream Products

• 1205042-14-3 1-benzyl-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid pyridin-3-ylamide 

Relevant articles and documents

Tri-Substituted Triazole-Enabled C-H Activation of Benzyl and Aryl Amines by Iron Catalysis

The design of trisubstituted triazoles set the stage for proximity-induced iron-catalyzed C-H activation of benzyl and aryl amines with ample scope. Thereby, C-H alkylations and C-H arylations proved viable with high levels of chemo and positional selectivities by means of racemization-free iron catalysis with the reusable triazole being removed in a traceless fashion.

Design, synthesis, and fungicidal activities of novel 5-methyl-1H-1,2,3- Trizole-4-carboxyl amide analogues

Succinate dehydrogenase inhibitors (SDHIs) are fungicides with an amide bond widely used to control plant diseases caused by phytopathogenic fungi. Because of broad spectrum activity of new SDHIs, they have attracted wide attention from the research community. A series of structurally novel SDHIs with a bioactive 1,2,3-triazole moiety were designed and synthesized. Bioactivity screening showed that some of designed N-phenethyl-1,2,3-trizole-4-carboxyl amide analogues exhibited good fungicidal activities toward Sclerotinia sclerotiorum and Botrytis cinerea, while some of Nbenzyl- 1,2,3-trizole-4-carboxyl amide analogues exhibited good fungicidal activities toward Phytophthora capsici and Cercospora arachidicola. EC50 value of compound 5d against Cercospora arachidicola (6.6 μg/mL) was lower than that of chlorothalonil (12.3 μg/mL).

SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF

Disclosed are compounds having enhanced potency in the modulation of NMDA receptor activity. Such compounds are contemplated for use in the treatment of conditions such as depression and related disorders. Orally available formulations and other pharmaceutically acceptable delivery forms of the compounds, including intravenous formulations, are also disclosed.