4600-06-0

Basic information

• Product Name: 1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-nitrophenyl)-
• Synonyms: 1-(4-Nitro-phenyl)-1H-[1,2,3]triazol-4-carbonsaeure;1-p-nitrophenyl-1H-[1,2,3]-triazole 4-carboxylic acid;1-(4-Nitro-phenyl)-1H-[1,2,3]triazole-4-carboxylic acid;1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylic acid;1-(4-Nitro-phenyl)-1,2,3-triazol-4-carbonsaeure;1-(4-Nitro-phenyl)-1,2,3-triazol-carbonsaeure-(4)
• CAS NO: 4600-06-0
• Molecular Formula: C9H6N4O4
• Molecular Weight: 234.171
• Mol File: 4600-06-0.mol
• Article Data: 6

Chemical Properties

• Melting Point: 220 °C
• Boiling Point: 527.1±56.0 °C(Predicted)
• Density: 1.66±0.1 g/cm3(Predicted)
• CAS DataBase Reference: 1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-nitrophenyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-nitrophenyl)-(4600-06-0)
• EPA Substance Registry System: 1H-1,2,3-Triazole-4-carboxylic acid, 1-(4-nitrophenyl)-(4600-06-0)

Safety Data

• Hazardous Substances Data: 4600-06-0(Hazardous Substances Data)

Usage

Derivative of triazole

The compound is based on a triazole ring, which is a five-membered ring with three nitrogen atoms and two carbon atoms.

Contains a carboxylic acid

The compound has a carboxylic acid functional group (-COOH) attached to the triazole ring, which gives it acidic properties.

Contains a nitrophenyl group

The compound also has a nitrophenyl group (-C6H4NO2) attached to the triazole ring, which is a group consisting of a phenyl ring with a nitro group (-NO2) attached.

Building block in organic synthesis

The compound is often used as an intermediate in the synthesis of more complex organic molecules.

Utilized in production of pharmaceuticals, agrochemicals, and materials science

The compound can be used to produce a variety of products, including drugs, pesticides, and other materials.

Unique structure and reactivity

The compound's structure and chemical properties make it a valuable intermediate in the synthesis of various compounds and materials.

Upstream product

• 100-01-6 4-nitro-aniline 
• 1516-60-5 4-nitrophenyl azide 
• 471-25-0 Propiolic acid 
• 24067-17-2 4-nitrophenylboronic acid 
• 133902-67-7 ethyl 1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate 
• 90886-87-6 1‐(4‐nitrophenyl)‐1H‐1,2,3‐triazole‐4‐yl‐methanol 
• 7732-18-5 water 
• 82936-41-2 1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbonitrile 

Downstream Products

• 1422423-70-8 4-(decyloxy)phenyl 1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate 
• 1422423-74-2 4-(decyloxy)biphenyl 1-(4-nitrophenyl)-1H-1,2,3-triazole-4-carboxylate 
• 1422423-67-3 C₉H₅ClN₄O₃ 
• 1446275-83-7 C₅₄H₇₈N₄O₃ 
• 1446275-84-8 C₅₅H₈₀N₄O₃ 
• 1446275-85-9 C₅₆H₇₂N₄O₅ 
• 1446275-87-1 C₅₈H₇₆N₄O₅ 
• 1446275-88-2 C₅₉H₇₈N₄O₅ 
• 1446275-89-3 C₆₀H₈₀N₄O₅ 
• 1446275-90-6 C₆₁H₈₂N₄O₅ 
• 1446275-91-7 C₆₂H₈₄N₄O₅ 
• 1446275-77-9 cholesteryl(1-(4-aminophenyl)-1H-1,2,3-triazole-4-carboxylate) 
• 1446275-78-0 C₄₉H₆₈N₄O₃ 
• 1446275-79-1 C₅₀H₇₀N₄O₃ 

Relevant articles and documents

Synthesis, characterization, and biological evaluation of new derivatives targeting MbtI as antitubercular agents

Tuberculosis (TB) causes millions of deaths every year, ranking as one of the most dangerous infectious diseases worldwide. Because several pathogenic strains of Mycobacterium tuberculosis (Mtb) have developed resistance against most of the established anti-TB drugs, new therapeutic options are urgently needed. An attractive target for the development of new antitubercular agents is the salicylate synthase MbtI, an essential enzyme for the mycobacterial siderophore biochemical machinery, absent in human cells. A set of analogues of I and II, two of the most potent MbtI inhibitors identified to date, was synthesized, characterized, and tested to elucidate the structural requirements for achieving an efficient MbtI inhibition and a potent antitubercular activity with this class of compounds. The structure-activity relationships (SAR) here discussed evidenced the importance of the furan as part of the pharmacophore and led to the preparation of six new compounds (IV-IX), which gave us the opportunity to examine a hitherto unexplored position of the phenyl ring. Among them emerged 5-(3-cyano-5-(trifluoromethyl)phenyl)furan-2-carboxylic acid (IV), endowed with comparable inhibitory properties to the previous leads, but a better antitubercular activity, which is a key issue in MbtI inhibitor research. Therefore, compound IV offers promising prospects for future studies on the development of novel agents against mycobacterial infections.

One-Pot Synthesis of 1-Monosubstituted 1,2,3-Triazoles from Propargyl Alcohol

A one-pot synthesis of 1-monosubstituted-1,2,3-triazoles from propargyl alcohol and various aryl azides was achieved. This simple method provides concise and efficient access to various 1-monosubstituted 1,2,3-triazole derivatives through a three-step one

Synthesis and mesomorphic properties of novel [1,2,3]-triazole mesogenic based compounds

A series of five-membered heterocyclic 1,2,3-triazole derivatives with different substituents in N1 position was synthesized. The heterocyclic moiety was connected through an ester function to a p-decyloxyphenyl or p-decyloxybiphenyl tails Polarized micro