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4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile

CAS 959271-96-6Formula C12H6ClF3N2OMW 286.63PubChem 6421032

A quinoline derivative featuring chloro, methoxy, trifluoromethyl, and carbonitrile functionalities, 4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile (CAS 959271-96-6) is a research-use chemical. Its complex structure makes it a valuable building block for synthesizing more intricate organic compounds, particularly within pharmaceutical and agrochemical research.

Loading RDKit molecule structure...
InChIKey: MJVGKFJOTCTMDJ-UHFFFAOYSA-NC12H6ClF3N2O | MW 286.63

Chemical Identity

Molecular Formula

C12H6ClF3N2O

Molecular Weight

286.63 g/mol

Exact Mass

286.012075

PubChem CID

6421032

SMILES String

COc1ccc2nc(C(F)(F)F)c(C#N)c(Cl)c2c1

Names & Synonyms

4-Chloro-6-methoxy-2-(trifluoromethyl)-quinoline-3-carbonitrileMJVGKFJOTCTMDJ-UHFFFAOYSA-N4-Chloro-6-methoxy-2-trifluoromethylquinoline-3-carbonitrile
External Identifiers
DTXSID00423598AKOS005263934SB69929DB-080375

Catalog Overview

4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile, identified by CAS 959271-96-6, is an organic compound characterized by a quinoline heterocyclic core. This core is substituted with a chlorine atom at position 4, a methoxy group at position 6, a trifluoromethyl group at position 2, and a carbonitrile group at position 3. With a molecular formula of C12H6ClF3N2O and a molecular weight of 286. 63, this compound presents a versatile scaffold for chemical synthesis.

Use Context

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

4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile, identified by CAS 959271-96-6, is an organic compound characterized by a quinoline heterocyclic core. This core is substituted with a chlorine atom at position 4, a methoxy group at position 6, a trifluoromethyl group at position 2, and a carbonitrile group at position 3. With a molecular formula of C12H6ClF3N2O and a molecular weight of 286.63, this compound presents a versatile scaffold for chemical synthesis. Its combination of halogen, ether, and nitrile functionalities, alongside the electron-withdrawing trifluoromethyl group, contributes to its reactivity and potential for diverse chemical transformations. It is primarily intended for research and development applications.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline powder

Physical State

Solid

Melting Point

165.0 °C

Boiling Point

330.0 °C

Density

1.51 g/cm³

Water Solubility

Insoluble

Flash Point

159.9 °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 4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. In case of contact, rinse thoroughly with water. Consult the Safety Data Sheet (SDS) for comprehensive safety information and emergency procedures. Store in a cool, dry place, away from incompatible materials.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Similar products (text references)

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Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 293349GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.