Cas no 1155064-44-0 (1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid)

1-(Prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid is a versatile heterocyclic compound featuring a pyrazole core functionalized with a carboxylic acid group and an allyl substituent. This structure imparts reactivity suitable for further derivatization, making it valuable in synthetic organic chemistry and pharmaceutical research. The carboxylic acid moiety allows for easy conversion into esters, amides, or other derivatives, while the allyl group offers potential for cross-coupling or polymerization reactions. Its balanced polarity enhances solubility in common organic solvents, facilitating handling in laboratory settings. The compound’s well-defined reactivity profile makes it a useful intermediate in the development of agrochemicals, pharmaceuticals, and functional materials.
1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid structure
1155064-44-0 structure
Product Name:1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid
CAS No:1155064-44-0
MF:C7H8N2O2
MW:152.150621414185
MDL:MFCD12139605
CID:4573453
PubChem ID:43565283
Update Time:2025-06-10

1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-allyl-1H-pyrazole-4-carboxylic acid
    • 1-(Prop-2-enyl)-1h-pyrazole-4-carboxylic acid
    • 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid
    • MDL: MFCD12139605
    • Inchi: 1S/C7H8N2O2/c1-2-3-9-5-6(4-8-9)7(10)11/h2,4-5H,1,3H2,(H,10,11)
    • InChI Key: LBTTVMITLWQTSR-UHFFFAOYSA-N
    • SMILES: N1(CC=C)C=C(C(O)=O)C=N1

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Additional information on 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid

1-(Prop-2-en-1-yl)-1H-pyrazole-4-carboxylic Acid: A Comprehensive Overview

The compound with CAS No. 1155064-44-0, commonly referred to as 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid, is a fascinating molecule that has garnered significant attention in the fields of organic chemistry and pharmacology. This compound belongs to the class of pyrazole derivatives, which are known for their versatile applications in drug discovery and agrochemicals. The structure of this compound features a pyrazole ring substituted with a propenyl group and a carboxylic acid moiety, making it a unique candidate for various chemical transformations and biological evaluations.

Recent studies have highlighted the potential of pyrazole derivatives in modulating key biological targets, such as kinases and ion channels, which are critical in disease pathways. For instance, researchers have explored the ability of 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid to inhibit specific enzymes involved in inflammation and cancer progression. These findings underscore the importance of this compound as a lead molecule for drug development.

The synthesis of 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid typically involves multi-step processes that leverage modern organic synthesis techniques. One common approach includes the cyclization of appropriate precursors under controlled conditions to form the pyrazole ring, followed by functionalization to introduce the propenyl and carboxylic acid groups. The optimization of these steps has been a focus of recent research, aiming to enhance yield and purity while minimizing environmental impact.

In terms of applications, this compound has shown promise in several areas. In agriculture, it has been investigated for its potential as a herbicide or fungicide due to its ability to disrupt key metabolic pathways in plant pathogens. Additionally, in the pharmaceutical sector, its role as an intermediate in drug synthesis has been explored, particularly in the development of anti-inflammatory and anti-cancer agents.

Recent advancements in computational chemistry have also played a pivotal role in understanding the properties of 1-(prop-2-en-1-yl)-1H-pyrazole-4-carboxylic acid. Molecular modeling studies have provided insights into its interactions with biological targets at the atomic level, enabling researchers to design more effective analogs. Furthermore, green chemistry approaches have been integrated into its synthesis, aligning with global efforts to promote sustainable practices in chemical manufacturing.

The future prospects for this compound are bright, with ongoing research focusing on expanding its utility across diverse industries. As new applications emerge and synthetic methods continue to evolve, 1-(prop-2-en-1-yli)-pyrazole carboxylic acid is poised to make significant contributions to both academic and industrial advancements.

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