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4-Fluoro-2-(trifluoromethyl)-DL-phenylalanine

CAS 1259997-93-7Formula C10H9F4NO2MW 251.18PubChem 66523475

4-Fluoro-2-(trifluoromethyl)-DL-phenylalanine is a fluorinated phenylalanine derivative, often utilized in research as a building block for synthesizing more complex molecules. Its unique structural features, including a trifluoromethyl group and a fluorine atom on the phenyl ring, make it valuable in medicinal chemistry and drug discovery efforts, particularly for developing compounds with altered pharmacokinetic properties.

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InChIKey: NICCVNASMKOGPH-UHFFFAOYSA-NC10H9F4NO2 | MW 251.18

Chemical Identity

Molecular Formula

C10H9F4NO2

Molecular Weight

251.18 g/mol

Exact Mass

251.056941

PubChem CID

66523475

IUPAC Name

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

SMILES String

NC(Cc1ccc(F)cc1C(F)(F)F)C(=O)O

Names & Synonyms

2-Amino-3-(4-fluoro-2-(trifluoromethyl)phenyl)propanoic acid4-Fluoro-2-trifluoromethyl-DL-phenylalanine2-Amino-3-(4-fluoro-2-(trifluoromethyl)phenyl)propanoicacid
External Identifiers
MFCD09914879AKOS015956994CS-0269264EN300-1937823

Catalog Overview

4-Fluoro-2-(trifluoromethyl)-DL-phenylalanine, identified by CAS 1259997-93-7, is a synthetic amino acid derivative. It features a phenylalanine backbone substituted with a fluorine atom at the 4-position and a trifluoromethyl group at the 2-position on the phenyl ring. With a molecular formula of C10H9F4NO2 and a molecular weight of 251. 18, this compound is classified within the research-oriented chemical scaffold.

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Read more catalog context

4-Fluoro-2-(trifluoromethyl)-DL-phenylalanine, identified by CAS 1259997-93-7, is a synthetic amino acid derivative. It features a phenylalanine backbone substituted with a fluorine atom at the 4-position and a trifluoromethyl group at the 2-position on the phenyl ring. With a molecular formula of C10H9F4NO2 and a molecular weight of 251.18, this compound is classified within the research-oriented chemical scaffold. The incorporation of fluorine and trifluoromethyl groups is a common strategy in pharmaceutical research to enhance metabolic stability, lipophilicity, and binding affinity of potential drug candidates. As a DL-phenylalanine derivative, it represents a racemic mixture, offering versatility for various synthetic routes in academic and industrial research settings. It serves as a key intermediate in the synthesis of novel compounds for diverse research applications.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline powder

Physical State

Solid

Melting Point

210.0 °C

Boiling Point

380.0 °C

Density

1.45 g/cm³

Water Solubility

Soluble

Flash Point

250.0 °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 4-Fluoro-2-(trifluoromethyl)-DL-phenylalanine in a well-ventilated area, preferably under a fume hood. Wear appropriate personal protective equipment, including safety glasses, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures.

Related Products / Graph Discovery

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