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3-Chloro-4-(trifluoromethyl)-DL-phenylalanine

CAS 1259966-92-1Formula C10H9ClF3NO2MW 267.63PubChem 57367825

3-Chloro-4-(trifluoromethyl)-DL-phenylalanine is a racemic, halogenated derivative of the amino acid phenylalanine. With a molecular formula of C10H9ClF3NO2 and a molecular weight of 267.63, it is primarily used in research as a chemical building block or for studies in medicinal chemistry.

Loading RDKit molecule structure...
InChIKey: GCHIBFDCLZYKFI-UHFFFAOYSA-NC10H9ClF3NO2 | MW 267.63

Chemical Identity

Molecular Formula

C10H9ClF3NO2

Molecular Weight

267.63 g/mol

Exact Mass

267.027391

PubChem CID

57367825

IUPAC Name

2-amino-3-[3-chloro-4-(trifluoromethyl)phenyl]propanoic acid

SMILES String

NC(Cc1ccc(C(F)(F)F)c(Cl)c1)C(=O)O

Names & Synonyms

2-Amino-3-(3-chloro-4-(trifluoromethyl)phenyl)propanoic acid3-Chloro-4-(trifluoromethyl)-DL-phenylalanine (H-DL-Phe(3-Cl,4-CF3)-OH)2-Amino-3-(3-chloro-4-(trifluoromethyl)phenyl)propanoicacid2-Amino-3-[3-chloro-4-(trifluoromethyl)phenyl]propionic acid
External Identifiers
MFCD11519330SCHEMBL22444773AKOS015957017CS-0443119EN300-1930465

Catalog Overview

3-Chloro-4-(trifluoromethyl)-DL-phenylalanine, identified by CAS 1259966-92-1 and PubChem CID 57367825, is a synthetic amino acid derivative. Its IUPAC name is 2-amino-3-[3-chloro-4-(trifluoromethyl)phenyl]propanoic acid. This compound features a phenylalanine backbone substituted with a chlorine atom and a trifluoromethyl group on the phenyl ring. Classified within the 'druglike_bioactive_like' structural bucket, it serves as a valuable research chemical for synthesizing novel compounds, exploring structure-activity relationships, or investigating biochemical pathways in various scientific disciplines.

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

200.0 °C

Density

1.4 g/cm³

Water Solubility

Slightly soluble

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 3-Chloro-4-(trifluoromethyl)-DL-phenylalanine with appropriate personal protective equipment (PPE), including gloves, eye protection, and a lab coat. Work in a well-ventilated area or fume hood to minimize exposure. Avoid inhalation, ingestion, and skin contact. Store in a cool, dry place, away from incompatible materials. Dispose of waste in accordance with local regulations.

Related Products / Graph Discovery

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

Related CAS / Similar Products

2,2,2-trifluoroethyl N-(3-chloro-2-methylphenyl)carbamateCAS 1087797-97-45-Chloro-2-(trifluoromethyl)-DL-phenylalanineCAS 1256482-62-82,2,2-trifluoroethyl N-(3-chloro-4-methylphenyl)carbamateCAS 877964-35-72,2,2-trifluoroethyl N-(5-chloro-2-methylphenyl)carbamateCAS 1087788-56-42,2,2-trifluoroethyl N-(2-chloro-4-methylphenyl)carbamateCAS 1087798-35-3

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 29224990GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

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

Catalog navigation

Related catalog entries

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

CAS 1256482-62-85-Chloro-2-(trifluoromethyl)-DL-phenylalanineCAS 1087788-56-42,2,2-trifluoroethyl N-(5-chloro-2-methylphenyl)carbamateCAS 1087797-97-42,2,2-trifluoroethyl N-(3-chloro-2-methylphenyl)carbamateCAS 1087798-35-32,2,2-trifluoroethyl N-(2-chloro-4-methylphenyl)carbamateCAS 877964-35-72,2,2-trifluoroethyl N-(3-chloro-4-methylphenyl)carbamateCAS 1259961-84-63-Chloro-5-(trifluoromethyl)-DL-phenylalanineCAS 1259973-98-22-Chloro-3-(trifluoromethyl)-DL-phenylalanineCAS 63687-03-64-Chloro-3-(trifluoromethyl)-DL-phenylalanine