3,5-Dimethyl-4-nitroisoxazole TCI D4506

Chemical Identity

CAS No.: 1123-49-5
PubChem: CID 261410·SID 253661812
Formula: C5H6N2O3
Molecular weight: 142.11 g/mol
Purity: >98.0%(GC)
Reference databases: ECHA

Full identifiers (IUPAC, SMILES, InChIKey)

IUPAC: 3,5-dimethyl-4-nitro-1,2-oxazole
SMILES: CC1=C(C(=NO1)C)[N+](=O)[O-]
InChIKey: PMQFLWLYAXYFHG-UHFFFAOYSA-N

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3,5-Dimethyl-4-nitroisoxazole is a chemical compound widely used as a building block in the synthesis of heterocyclic compounds. This versatile reagent plays a crucial role in organic chemistry laboratories, where it serves as a foundational material for creating complex molecular structures. Its unique chemical structure, featuring a nitro group and two methyl groups, contributes to its reactivity and functional versatility. In research settings, it is highly valued for its ability to participate in various chemical reactions, making it an essential tool for chemists working on drug development and material science.

The compound’s high reactivity, particularly in substitution and electrophilic reactions, makes it a preferred choice for synthetic chemists. Its heterocyclic framework allows it to engage in a range of reactions, including nitroso and catalytic processes, which are vital for the synthesis of pharmaceuticals and advanced materials. The compound’s ability to undergo multiple reaction pathways enhances its utility in laboratory applications. Additionally, its stability under controlled conditions ensures reliable performance during experiments, contributing to its popularity among researchers.

In Indonesian laboratories, 3,5-Dimethyl-4-nitroisoxazole is commonly used in pharmaceutical and organic chemistry research. It is a key reagent in the development of new drugs and functional materials. Its availability and chemical properties make it a standard component in many research projects, supporting both academic and industrial chemical investigations.

Related TCI products

Pharmaceutical research utilizes this compound for synthesizing novel drug molecules due to its reactivity and structural versatility.
Organic chemistry experiments benefit from its ability to participate in substitution and electrophilic reactions, enhancing synthetic pathways.
Material science applications leverage its heterocyclic structure for creating advanced polymers and functional materials.
Analytical chemistry uses it as a reference standard for testing reaction mechanisms and chemical behavior under various conditions.
Industrial chemical processes incorporate it as a building block for producing specialized compounds with specific functional groups.

Brand	TCI
CAS number	1123-49-5
Molecular formula	—
Purity	—
Category	Chemistry > Building Blocks > Heterocyclic Building Blocks
Pack sizes	Available in various quantities as per supplier specifications
Physical form	Solid, crystalline powder
Storage	Store in a cool, dry place away from light and incompatible substances

This compound should be stored in a cool, dry environment, away from direct sunlight and sources of heat. It is recommended to use airtight containers to prevent moisture absorption and contamination. Due to its reactivity, it should be handled in a well-ventilated laboratory setting, preferably with appropriate personal protective equipment. Avoid contact with incompatible materials such as strong acids or bases. Keep the substance in a secure location to prevent accidental exposure. Regular monitoring of storage conditions ensures the compound remains stable and suitable for use in laboratory applications.

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