92614-86-3

Basic information

• Product Name: 3-TETRAZOL-1-YL-PROPIONIC ACID
• Synonyms: 1H-Tetrazole-1-propanoicacid;TIMTEC-BB SBB000087;3-(1H-1,2,3,4-TETRAZOL-1-YL)PROPANOIC ACID;3-TETRAZOL-1-YL-PROPIONIC ACID;CHEMBRDG-BB 4009259;3-(1H-tetrazol-1-yl)propanoic acid;Albb-007422;3-(1H-tetrazol-1-yl)propanoic acid(SALTDATA: FREE)
• CAS NO: 92614-86-3
• Molecular Formula: C₄H₆N₄O₂
• Molecular Weight: 142.12
• Mol File: 92614-86-3.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 377°C at 760 mmHg
• Flash Point: 181.8°C
• Appearance: /
• Density: 1.61g/cm³
• Vapor Pressure: 2.36E-06mmHg at 25°C
• Refractive Index: 1.682
• CAS DataBase Reference: 3-TETRAZOL-1-YL-PROPIONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-TETRAZOL-1-YL-PROPIONIC ACID(92614-86-3)
• EPA Substance Registry System: 3-TETRAZOL-1-YL-PROPIONIC ACID(92614-86-3)

Safety Data

• Hazard Codes: Xi
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 92614-86-3(Hazardous Substances Data)

Usage

General Description

3-Tetrazol-1-yl-propionic acid is a chemical compound with the molecular formula C6H9N5O2. It is a derivative of tetrazole and propionic acid. 3-TETRAZOL-1-YL-PROPIONIC ACID has potential pharmaceutical significance due to its ability to act as a non-steroidal anti-inflammatory drug (NSAID) similar to aspirin and ibuprofen. It has been studied for its anti-inflammatory and analgesic properties, making it a potential candidate for the development of new drugs for treating pain and inflammation. Additionally, research has shown that 3-Tetrazol-1-yl-propionic acid may also have potential applications in the treatment of cardiovascular diseases, making it an important compound for further investigation in the pharmaceutical industry.

InChI:InChI=1/C4H6N4O2/c9-4(10)1-2-8-3-5-6-7-8/h3H,1-2H2,(H,9,10)

Upstream product

• 122-51-0 orthoformic acid triethyl ester 
• 107-95-9 3-amino propanoic acid 
• 288-94-8 1H-tetrazole 
• 79-10-7 acrylic acid 
• 590-92-1 3-Bromopropionic acid 

Downstream Products

• 149267-87-8 N-(3-(tetrazol-1-yl)-propionyl)-(L)-valine-benzyl ester 

Relevant articles and documents

Bifunctional Fe(ii) spin crossover-complexes based on ω-(1: H -tetrazol-1-yl) carboxylic acids

To increase the supramolecular cooperativity in Fe(ii) spin crossover materials based on N1-substituted tetrazoles, a series of ω-(1H-tetrazol-1-yl) carboxylic acids with chain-lengths of C2-C4 were synthesized. Structural characterization confirmed the formation of a strong hydrogen-bond network, responsible for enhanced cooperativity in the materials and thus largely complete spin-state transitions for the ligands with chain lenghts of C2 and C4. To complement the structural and magnetic investigation, electronic spectroscopy was used to investigate the spin-state transition. An initial attempt to utilize the bifunctional coordination ability of the ω-(1H-tetrazol-1-yl) carboxylic acids for preparation of mixed-metallic 3d-4f coordination polymers resulted in a novel one-dimensional gadolinium-oxo chain system with the ω-(1H-tetrazol-1-yl) carboxylic acid acting as μ2-η2:η1 chelating-bridging ligand.

Synthesis of tetrazole analogues of phosphonohydroxamic acids: An attempt to improve the inhibitory activity against the DXR

This work is focused on the design of new antimicrobial drugs and on the development of lipophilic inhibitors of the DXR, the second enzyme of the MEP pathway for the biosynthesis of isoprene units in most bacteria, by replacing the phosphonate group of fosmidomycin derivatives by a tetrazoyl moiety capable of multiple hydrogen bonding. The N- and C-substituted tetrazole analogues of phosphonohydroxamate inhibitors were synthesized and tested on the DXR of Escherichia coli. This work points out the hypothesis that the phosphonate/phosphate recognition site might be too rigid to accommodate other functional groups.

SYNTHESIS OF 1-SUBSTITUTED TETRAZOLES BY HETEROCYCLIZATION OF PRIMARY AMINES, ORTHOFORMIC ESTER, AND SODIUM AZIDE

It has been shown that the reaction of heterocyclization of primary amines with orthoformic acid and sodium azide in acetic acid has a rather general character and is a convenient method for the synthesis of 1-substituted tetrazoles.On the basis of experimental data, a probable reaction mechanism is proposed.