Chemical Identity
Molecular Formula
C9H5BrF4O3
Molecular Weight
317.03 g/mol
Exact Mass
315.93582
PubChem CID
154645222
SMILES String
COc1c(C(F)(F)F)cc(Br)c(C(=O)O)c1F
Names & Synonyms
External Identifiers
Catalog Overview
6-Bromo-2-fluoro-3-methoxy-4-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzoic acid core substituted with a bromine atom, a fluorine atom, a methoxy group, and a trifluoromethyl group. This combination of halogen and ether functionalities, along with the carboxylic acid, makes it a versatile chemical intermediate. Its molecular formula is C9H5BrF4O3 and its molecular weight is approximately 317. 03 g/mol.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
6-Bromo-2-fluoro-3-methoxy-4-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzoic acid core substituted with a bromine atom, a fluorine atom, a methoxy group, and a trifluoromethyl group. This combination of halogen and ether functionalities, along with the carboxylic acid, makes it a versatile chemical intermediate. Its molecular formula is C9H5BrF4O3 and its molecular weight is approximately 317.03 g/mol. Given its "druglike_bioactive_like" structural classification, it may be of interest in drug discovery research, particularly for synthesizing novel compounds with potential biological activities or as a scaffold for lead synthetic exploration studies.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
white crystalline solid
Physical State
solid
Melting Point
200.0 °C
Boiling Point
380.0 °C
Density
1.8 g/cm³
Water Solubility
slightly soluble
Flash Point
200.0 °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 6-Bromo-2-fluoro-3-methoxy-4-(trifluoromethyl)benzoic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment (PPE), 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. Store in a cool, dry place, away from incompatible materials. Always consult 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.
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.