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2-amino-3-[2-fluoro-5-(trifluoromethyl)phenyl]propanoic Acid

CAS 1259994-87-0Formula C10H9F4NO2MW 251.18PubChem 5006593

2-amino-3-[2-fluoro-5-(trifluoromethyl)phenyl]propanoic Acid 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 in organic synthesis and medicinal chemistry as a versatile building block.

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

Chemical Identity

Molecular Formula

C10H9F4NO2

Molecular Weight

251.18 g/mol

Exact Mass

251.056941

PubChem CID

5006593

SMILES String

NC(Cc1cc(C(F)(F)F)ccc1F)C(=O)O

Names & Synonyms

2-FLUORO-5-(TRIFLUOROMETHYL)-DL-PHENYLALANINE2-Amino-3-(2-fluoro-5-(trifluoromethyl)phenyl)propanoic acid2-Fluoro-5-(trifluoromethyl)-DL-phenylalanine (H-DL-Phe(2-F,5-CF3)-OH)
External Identifiers
MFCD04115996SBB100913AKOS015956769DB-293044CS-0268023EN300-1931353

Catalog Overview

2-amino-3-[2-fluoro-5-(trifluoromethyl)phenyl]propanoic Acid (CAS 1259994-87-0, C10H9F4NO2) is a synthetic amino acid derivative. This compound features a phenyl group substituted with both a fluorine atom and a trifluoromethyl group, attached to an alanine backbone. Its unique fluorinated aromatic structure makes it a valuable building block in organic synthesis, particularly in medicinal chemistry and drug discovery where fluorinated compounds are often investigated for their modified physicochemical properties and metabolic stability. It is classified within the research-oriented chemical scaffold, indicating its potential...

Use Context

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

2-amino-3-[2-fluoro-5-(trifluoromethyl)phenyl]propanoic Acid (CAS 1259994-87-0, C10H9F4NO2) is a synthetic amino acid derivative. This compound features a phenyl group substituted with both a fluorine atom and a trifluoromethyl group, attached to an alanine backbone. Its unique fluorinated aromatic structure makes it a valuable building block in organic synthesis, particularly in medicinal chemistry and drug discovery where fluorinated compounds are often investigated for their modified physicochemical properties and metabolic stability. It is classified within the research-oriented chemical scaffold, indicating its potential utility as a scaffold or intermediate in the development of novel chemical entities for research purposes.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

white crystalline solid

Physical State

solid

Melting Point

200.0 °C

Boiling Point

400.0 °C

Density

1.45 g/cm³

Water Solubility

sparingly 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
  • For research use only. Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to prevent inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before use.

Related Products / Graph Discovery

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

Similar products (text references)

2,2,2-trifluoroethyl N-(5-fluoro-2-methylphenyl)carbamateCAS 1087788-89-3
2,2,2-trifluoroethyl N-(3-fluoro-4-methylphenyl)carbamateCAS 1087798-07-9
2-amino-3-[2-fluoro-4-(trifluoromethyl)phenyl]propanoic AcidCAS 439587-15-2
2,2,2-trifluoroethyl N-(2-fluoro-5-methylphenyl)carbamateCAS 1087797-87-2
2,2,2-trifluoroethyl N-(2-fluoro-4-methylphenyl)carbamateCAS 1087788-97-3

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.