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5-Fluoro-4-methoxy-3-(trifluoromethyl)benzoic acid

CAS 2244107-74-0Formula C9H6F4O3MW 238.14PubChem 145705801

5-Fluoro-4-methoxy-3-(trifluoromethyl)benzoic acid is a fluorinated and methoxylated benzoic acid derivative featuring a trifluoromethyl group. It is intended for research and development applications as a chemical intermediate in organic synthesis.

Loading RDKit molecule structure...
InChIKey: ZWBNYDCDHMIGGU-UHFFFAOYSA-NC9H6F4O3 | MW 238.14

Chemical Identity

Molecular Formula

C9H6F4O3

Molecular Weight

238.14 g/mol

Exact Mass

238.025307

PubChem CID

145705801

IUPAC Name

3-fluoro-4-methoxy-5-(trifluoromethyl)benzoic acid

SMILES String

COc1c(F)cc(C(=O)O)cc1C(F)(F)F

Names & Synonyms

E95051F630866
External Identifiers
MFCD31805758SCHEMBL30740950CS-0193189

Catalog Overview

5-Fluoro-4-methoxy-3-(trifluoromethyl)benzoic acid, identified by CAS 2244107-74-0, is an organic compound with the molecular formula C9H6F4O3 and a molecular weight of 238. 14 g/mol. It features a benzoic acid core substituted with a fluorine atom, a methoxy group, and a trifluoromethyl group. This compound is primarily utilized as a versatile building block and chemical intermediate in synthetic organic chemistry, particularly for the development and synthesis of novel fluorinated compounds in research and development settings.

Use Context

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

5-Fluoro-4-methoxy-3-(trifluoromethyl)benzoic acid, identified by CAS 2244107-74-0, is an organic compound with the molecular formula C9H6F4O3 and a molecular weight of 238.14 g/mol. It features a benzoic acid core substituted with a fluorine atom, a methoxy group, and a trifluoromethyl group. This compound is primarily utilized as a versatile building block and chemical intermediate in synthetic organic chemistry, particularly for the development and synthesis of novel fluorinated compounds in research and development settings. Its unique structural characteristics make it valuable for exploring structure-activity relationships and advancing chemical synthesis.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline solid

Physical State

Solid

Melting Point

135.0 °C

Boiling Point

280.0 °C

Density

1.4 g/cm³

Water Solubility

Slightly soluble

Flash Point

175.0 °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 with appropriate personal protective equipment, including chemical-resistant gloves, safety glasses or goggles, and a lab coat. Ensure adequate ventilation or use in a fume hood to prevent inhalation. Avoid direct contact with skin, eyes, and clothing. Do not ingest. Store in a cool, dry, and well-ventilated area, away from incompatible materials. Always refer to the Safety Data Sheet (SDS) for comprehensive hazard information and safe handling procedures before use.

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: 291899GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

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

Catalog navigation

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.