Chemical Identity
Molecular Formula
C9H6BrF3O3
Molecular Weight
299.04 g/mol
Exact Mass
297.94524
PubChem CID
59438423
SMILES String
COc1cc(C(F)(F)F)cc(Br)c1C(=O)O
Names & Synonyms
External Identifiers
Catalog Overview
2-Bromo-6-methoxy-4-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzene ring substituted with a bromine atom, a methoxy group, a trifluoromethyl group, and a carboxylic acid group. Its molecular formula is C9H6BrF3O3 and its molecular weight is approximately 299. 04 g/mol. This compound's intricate substitution pattern makes it a valuable intermediate in the synthesis of more complex molecules, particularly in medicinal chemistry and agrochemical research, where halogenated and trifluoromethylated aromatic systems are often desired for their unique electronic and steric properties.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
2-Bromo-6-methoxy-4-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzene ring substituted with a bromine atom, a methoxy group, a trifluoromethyl group, and a carboxylic acid group. Its molecular formula is C9H6BrF3O3 and its molecular weight is approximately 299.04 g/mol. This compound's intricate substitution pattern makes it a valuable intermediate in the synthesis of more complex molecules, particularly in medicinal chemistry and agrochemical research, where halogenated and trifluoromethylated aromatic systems are often desired for their unique electronic and steric properties. It is intended for Research Use Only (RUO).
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
white solid
Physical State
solid
Melting Point
155.0 °C
Boiling Point
309.6 °C
Density
1.61 g/cm³
Water Solubility
2.2 × 10⁻³ mol/L
Flash Point
121.7 °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 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. This product is for research use only and not for human or animal therapeutic or diagnostic use.
Related Products / Graph Discovery
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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.