Chemical Identity
Molecular Formula
C9H6FNO2
Molecular Weight
179.15 g/mol
Exact Mass
179.038257
PubChem CID
130980145
SMILES String
Cc1cc(C#N)c(F)cc1C(=O)O
Names & Synonyms
External Identifiers
Catalog Overview
4-Cyano-5-fluoro-2-methylbenzoic acid, with CAS 1807296-40-7 and molecular formula C9H6FNO2, is an organic compound characterized by a benzoic acid core substituted with a cyano group at position 4, a fluoro group at position 5, and a methyl group at position 2. This compound is primarily utilized in research settings as a key building block for the synthesis of more complex molecules, particularly within pharmaceutical and agrochemical research due to its diverse functional groups.
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 solid
Physical State
Solid
Melting Point
165.0 °C
Boiling Point
380.0 °C
Density
1.45 g/cm³
Water Solubility
Very 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 4-Cyano-5-fluoro-2-methylbenzoic acid with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to minimize exposure. Avoid inhalation, ingestion, and skin contact. Store in a cool, dry place, away from incompatible materials. Refer to the Safety Data Sheet (SDS) for comprehensive safety information before handling.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related CAS / Similar Products
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.