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2-Amino-4-bromo-3-fluoro-5-(trifluoromethyl)benzoic acid

CAS 2134633-62-6Formula C8H4BrF4NO2MW 302.02PubChem 164568827

This compound is a halogenated benzoic acid derivative featuring an amino group, a carboxyl group, and trifluoromethyl, bromo, and fluoro substituents on a benzene ring. It is primarily intended for research and development applications as a chemical intermediate. For Research Use Only (RUO).

Loading RDKit molecule structure...
InChIKey: PKPFCLGECKRINR-UHFFFAOYSA-NC8H4BrF4NO2 | MW 302.02

Chemical Identity

Molecular Formula

C8H4BrF4NO2

Molecular Weight

302.02 g/mol

Exact Mass

300.93615

PubChem CID

164568827

SMILES String

Nc1c(C(=O)O)cc(C(F)(F)F)c(Br)c1F

Names & Synonyms

F89105F874158
External Identifiers
MFCD34645939SCHEMBL24616007PB48444PS-16194SY321668DB-376727

Catalog Overview

2-Amino-4-bromo-3-fluoro-5-(trifluoromethyl)benzoic acid, identified by CAS 2134633-62-6, is an organic compound with the molecular formula C8H4BrF4NO2 and a molecular weight of 302.02 g/mol. Its structure incorporates a benzene ring substituted with an amino group (-NH2), a carboxylic acid group (-COOH), a bromine atom, a fluorine atom, and a trifluoromethyl group (-CF3). This complex halogenation and functional group arrangement make it a potential building block or intermediate in the synthesis of more complex molecules, particularly within medicinal chemistry or agrochemical research, where similar "research-oriented" or...

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

2-Amino-4-bromo-3-fluoro-5-(trifluoromethyl)benzoic acid, identified by CAS 2134633-62-6, is an organic compound with the molecular formula C8H4BrF4NO2 and a molecular weight of 302.02 g/mol. Its structure incorporates a benzene ring substituted with an amino group (-NH2), a carboxylic acid group (-COOH), a bromine atom, a fluorine atom, and a trifluoromethyl group (-CF3). This complex halogenation and functional group arrangement make it a potential building block or intermediate in the synthesis of more complex molecules, particularly within medicinal chemistry or agrochemical research, where similar "research-oriented" or "research-oriented" scaffolds are often explored. It is supplied for Research Use Only (RUO).

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white crystalline powder

Physical State

Solid

Melting Point

175.0 °C

Boiling Point

350.0 °C

Density

1.8 g/cm³

Water Solubility

Slightly soluble

Flash Point

180.0 °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-fluoro-5-(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.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Similar products (text references)

254895-87-9CAS 254895-87-9
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2091425-28-2CAS 2091425-28-2
1087797-96-3CAS 1087797-96-3
1218643-85-6CAS 1218643-85-6

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 292249GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.

Catalog navigation

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.