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5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)nicotinonitrile

CAS 1092352-76-5Formula C8H4BrF3N2OMW 281.03PubChem 30772179

5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)nicotinonitrile is a halogenated nicotinonitrile derivative, often utilized in synthetic organic chemistry as a versatile building block for the creation of more complex chemical structures, particularly within drug discovery and agrochemical research.

Loading RDKit molecule structure...
InChIKey: LDROYAOVNZFOPG-UHFFFAOYSA-NC8H4BrF3N2O | MW 281.03

Chemical Identity

Molecular Formula

C8H4BrF3N2O

Molecular Weight

281.03 g/mol

Exact Mass

279.94591

PubChem CID

30772179

IUPAC Name

5-bromo-6-methyl-2-oxo-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

SMILES String

Cc1nc(O)c(C#N)c(C(F)(F)F)c1Br

Names & Synonyms

5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)-nicotinonitrile5-bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrileAS-813/435019025-Bromo-1,2-dihydro-6-methyl-2-oxo-4-(trifluoromethyl)-3-pyridinecarbonitrile
External Identifiers
MFCD11501053AKOS005073115KC-0712DB-397991CS-0367162

Catalog Overview

5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)nicotinonitrile is an organic compound characterized by a pyridine core substituted with a bromine atom, a hydroxyl group, a methyl group, a trifluoromethyl group, and a nitrile group. Its molecular formula is C8H4BrF3N2O and its molecular weight is approximately 281. 03 g/mol. This compound's diverse functional groups make it a valuable intermediate in the synthesis of various heterocyclic compounds and potential bioactive molecules.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)nicotinonitrile is an organic compound characterized by a pyridine core substituted with a bromine atom, a hydroxyl group, a methyl group, a trifluoromethyl group, and a nitrile group. Its molecular formula is C8H4BrF3N2O and its molecular weight is approximately 281.03 g/mol. This compound's diverse functional groups make it a valuable intermediate in the synthesis of various heterocyclic compounds and potential bioactive molecules. It is classified as a research-oriented/research-oriented compound, suggesting its relevance in medicinal chemistry and related fields for developing novel chemical entities.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

180.0 °C

Boiling Point

350.0 °C

Density

1.7 g/cm³

Water Solubility

Slightly soluble

Flash Point

185.0 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle 5-Bromo-2-hydroxy-6-methyl-4-(trifluoromethyl)nicotinonitrile with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures before use.

Related Products / Graph Discovery

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