Chemical Identity
Molecular Formula
C9H3F4NO2
Molecular Weight
233.12 g/mol
Exact Mass
233.009991
PubChem CID
131531781
SMILES String
N#Cc1c(C(F)(F)F)ccc(C(=O)O)c1F
Names & Synonyms
Catalog Overview
3-Cyano-2-fluoro-4-(trifluoromethyl)benzoic acid (CAS 1807246-47-4) is an aromatic carboxylic acid featuring a trifluoromethyl group, a cyano group, and a fluorine atom on the benzene ring. With a molecular formula of C9H3F4NO2 and a molecular weight of 233.12 g/mol, this compound serves as a versatile functionalized intermediate. Its distinct array of electron-withdrawing groups makes it a valuable reagent for various synthetic transformations, including Suzuki-Miyaura couplings, amide formations, and esterifications, especially in the development of novel compounds for life science research.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White crystalline powder
Physical State
Solid
Melting Point
175.0 °C
Boiling Point
380.0 °C
Density
1.5 g/cm³
Water Solubility
Slightly soluble
Flash Point
220.0 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- Handle 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. Consult the Safety Data Sheet (SDS) for comprehensive safety information before use.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related CAS / Similar Products
Similar products (text references)
Recommended application cues
Catalog discovery cues, not supplier-verified claims.
Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.