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2-Amino-3-chloro-5-(trifluoromethyl)benzoic acid

CAS 66232-38-0Formula C8H5ClF3NO2MW 239.58PubChem 20325587

2-Amino-3-chloro-5-(trifluoromethyl)benzoic acid is a highly functionalized benzoic acid derivative, featuring amino, chloro, and trifluoromethyl groups on an aromatic ring. It serves as a versatile building block in organic synthesis, particularly for the creation of complex molecules in pharmaceutical and agrochemical research.

Loading RDKit molecule structure...
InChIKey: BMAHACPCHDDGEY-UHFFFAOYSA-NC8H5ClF3NO2 | MW 239.58

Chemical Identity

Molecular Formula

C8H5ClF3NO2

Molecular Weight

239.58 g/mol

Exact Mass

238.996091

PubChem CID

20325587

SMILES String

Nc1c(Cl)cc(C(F)(F)F)cc1C(=O)O

Names & Synonyms

2-Amino-3-chloro-5-trifluoromethyl-benzoic acid
External Identifiers
SCHEMBL16529671MFCD24039093DB-392541

Catalog Overview

2-Amino-3-chloro-5-(trifluoromethyl)benzoic acid, with CAS 66232-38-0, is an organic compound characterized by a benzoic acid core substituted with an amino group at position 2, a chloro group at position 3, and a trifluoromethyl group at position 5. Its molecular formula is C8H5ClF3NO2 and its molecular weight is 239.58 g/mol. This compound's diverse functional groups make it a valuable intermediate for researchers engaged in the synthesis of novel chemical entities, including potential active pharmaceutical ingredients (APIs) and agrochemicals, where precise structural modifications are required.

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 to off-white crystalline powder

Physical State

Solid

Melting Point

160.5 °C

Boiling Point

369.8 °C

Density

1.6 g/cm³

Water Solubility

Very slightly soluble (1.7 × 10⁻⁴ g/L)

Flash Point

200.0 °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-3-chloro-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, to prevent skin and eye contact. Avoid inhalation of dust or vapors. Refer to the Safety Data Sheet (SDS) for comprehensive safety information, handling procedures, and emergency protocols. Store in a cool, dry place, away from incompatible materials.

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