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

CAS 1805097-26-0Formula C8H5F4NO2MW 223.12PubChem 119011075

2-Amino-4-fluoro-5-(trifluoromethyl)benzoic acid is a fluorinated aminobenzoic acid derivative, serving as a versatile chemical building block. Its structure features an amino group, a fluorine atom, and a trifluoromethyl group on a benzoic acid core.

Loading RDKit molecule structure...
InChIKey: HZOXFSHBNJIBDZ-UHFFFAOYSA-NC8H5F4NO2 | MW 223.12

Chemical Identity

Molecular Formula

C8H5F4NO2

Molecular Weight

223.12 g/mol

Exact Mass

223.025641

PubChem CID

119011075

SMILES String

Nc1cc(F)c(C(F)(F)F)cc1C(=O)O

Names & Synonyms

HZOXFSHBNJIBDZ-UHFFFAOYSA-NG68762
External Identifiers
MFCD27937177SCHEMBL21664323EN300-9844677

Catalog Overview

2-Amino-4-fluoro-5-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzoic acid moiety substituted with an amino group, a fluorine atom, and a trifluoromethyl group. With the molecular formula C8H5F4NO2 and a molecular weight of 223. 12, this compound is classified as a functionalized intermediate. Its unique combination of functional groups makes it a valuable reagent in synthetic organic chemistry, particularly for the construction of complex molecules where fluorine and trifluoromethyl groups are desired for their 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-Amino-4-fluoro-5-(trifluoromethyl)benzoic acid is an organic compound characterized by a benzoic acid moiety substituted with an amino group, a fluorine atom, and a trifluoromethyl group. With the molecular formula C8H5F4NO2 and a molecular weight of 223.12, this compound is classified as a functionalized intermediate. Its unique combination of functional groups makes it a valuable reagent in synthetic organic chemistry, particularly for the construction of complex molecules where fluorine and trifluoromethyl groups are desired for their electronic and steric properties. It is often employed in the synthesis of potential pharmaceutical agents, agrochemicals, and advanced materials.

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

380.0 °C

Density

1.5 g/cm³

Water Solubility

slightly soluble

Flash Point

190.0 °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-fluoro-5-(trifluoromethyl)benzoic acid with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or a chemical fume hood to avoid inhalation. Prevent skin and eye contact, and do not ingest. Always refer to the Safety Data Sheet (SDS) for comprehensive safety information and proper handling procedures.

Related Products / Graph Discovery

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

Similar products (text references)

1519285-71-2CAS 1519285-71-2

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.