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

CAS 1260004-58-7Formula C10H9F4NO2MW 251.18PubChem 4985657

This compound is a fluorinated phenylalanine derivative, featuring a trifluoromethyl group and a fluorine atom on the phenyl ring. It is primarily intended for research and development applications, particularly in medicinal chemistry and biochemical studies.

Loading RDKit molecule structure...
InChIKey: JKURDBSSRLCLKP-UHFFFAOYSA-NC10H9F4NO2 | MW 251.18

Chemical Identity

Molecular Formula

C10H9F4NO2

Molecular Weight

251.18 g/mol

Exact Mass

251.056941

PubChem CID

4985657

SMILES String

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

Names & Synonyms

4-FLUORO-3-(TRIFLUOROMETHYL)-DL-PHENYLALANINE2-Amino-3-(4-fluoro-3-(trifluoromethyl)phenyl)propanoic acid4-Fluoro-3-(trifluoromethyl)-DL-phenylalanine (H-DL-Phe(4-F,3-CF3)-OH)
External Identifiers
MFCD04116014SBB100908AKOS015956955CS-0268789EN300-1931524

Catalog Overview

2-amino-3-[4-fluoro-3-(trifluoromethyl)phenyl]propanoic Acid, identified by CAS 1260004-58-7, is a synthetic amino acid derivative. Its structure incorporates a phenylalanine backbone substituted with a fluorine atom at the 4-position and a trifluoromethyl group at the 3-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.

Use Context

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

2-amino-3-[4-fluoro-3-(trifluoromethyl)phenyl]propanoic Acid, identified by CAS 1260004-58-7, is a synthetic amino acid derivative. Its structure incorporates a phenylalanine backbone substituted with a fluorine atom at the 4-position and a trifluoromethyl group at the 3-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. It serves as a valuable building block or probe in various research applications, including the synthesis of novel pharmaceutical candidates, exploration of structure-activity relationships, and biochemical investigations where fluorinated amino acids are of interest. Its unique substitution pattern may confer specific physicochemical properties relevant to drug discovery and chemical biology.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline powder

Physical State

Solid

Melting Point

180.0 °C

Boiling Point

380.0 °C

Density

1.45 g/cm³

Water Solubility

Slightly soluble

Flash Point

220.0 °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 with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures. Store in a cool, dry place, tightly sealed.

Related Products / Graph Discovery

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

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.