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2-Amino-4-bromo-3-(trifluoromethyl)benzoic acid

CAS 1805624-14-9Formula C8H5BrF3NO2MW 284.03PubChem 119020348

2-Amino-4-bromo-3-(trifluoromethyl)benzoic acid is an organic compound with the formula C8H5BrF3NO2. This benzoic acid derivative features an amino group, a bromine atom, and a trifluoromethyl group, making it a versatile building block for various research applications.

Loading RDKit molecule structure...
InChIKey: NRXLWROYVUDNPL-UHFFFAOYSA-NC8H5BrF3NO2 | MW 284.03

Chemical Identity

Molecular Formula

C8H5BrF3NO2

Molecular Weight

284.03 g/mol

Exact Mass

282.94558

PubChem CID

119020348

SMILES String

Nc1c(C(=O)O)ccc(Br)c1C(F)(F)F

Names & Synonyms

829-661-0
External Identifiers
RefChem:464238MFCD28719644FXC62414EN300-6486921

Catalog Overview

2-Amino-4-bromo-3-(trifluoromethyl)benzoic acid, identified by CAS 1805624-14-9 and PubChem CID 119020348, is a halogenated and trifluoromethylated aminobenzoic acid. Its molecular structure includes an amino group at position 2, a carboxyl group at position 1, a bromine atom at position 4, and a trifluoromethyl group at position 3 on the benzene ring. With a molecular weight of 284.03 g/mol, this compound is of interest in synthetic organic chemistry, particularly for the synthesis of more complex molecules in 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

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline solid

Physical State

Solid

Melting Point

155.9 °C

Boiling Point

314.4 °C

Density

1.71 g/cm³

Water Solubility

3.94 × 10⁻³ mol/L

Flash Point

131.5 °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 2-Amino-4-bromo-3-(trifluoromethyl)benzoic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Avoid inhalation, ingestion, and skin contact. Refer to the Safety Data Sheet (SDS) for comprehensive safety information and emergency procedures. Store in a cool, dry place, away from incompatible materials.

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