Chemical Identity
Molecular Formula
C15H16F3NO2
Molecular Weight
299.29 g/mol
Exact Mass
299.113313
PubChem CID
121604886
IUPAC Name
benzyl (2R)-2-amino-2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]acetate
SMILES String
N[C@@H](C(=O)OCc1ccccc1)C12CC(C(F)(F)F)(C1)C2
Names & Synonyms
External Identifiers
Catalog Overview
Benzyl (2R)-2-amino-2-[3-(trifluoromethyl)bicyclo[1. 1. 1]pentan-1-yl]acetate is a complex organic molecule with a molecular formula of C15H16F3NO2 and a molecular weight of 299. 29 g/mol.
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
Benzyl (2R)-2-amino-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetate is a complex organic molecule with a molecular formula of C15H16F3NO2 and a molecular weight of 299.29 g/mol. It incorporates a chiral amino acid derivative structure, specifically a benzyl ester of an alpha-amino acid. A key feature is the presence of a 3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl moiety, which is a rigid, three-dimensional scaffold often employed in medicinal chemistry as a bioisostere for phenyl rings or as a constrained linker. The trifluoromethyl group is known to enhance lipophilicity, metabolic stability, and binding affinity in drug candidates. The (2R) stereochemistry at the alpha-carbon is precisely defined, making this compound valuable for stereoselective synthesis and studies requiring specific enantiomers. Its 'druglike_bioactive_like' structural classification suggests its potential as a building block for synthesizing novel compounds with biological activity.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White crystalline solid
Physical State
Solid
Melting Point
110.0 °C
Boiling Point
350.0 °C
Density
1.3 g/cm³
Water Solubility
Slightly soluble
Flash Point
200.0 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- Handle benzyl (2R)-2-amino-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetate with appropriate personal protective equipment (PPE), 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. Always consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures before use. Store in a cool, dry place, away from incompatible materials.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related products and analog discovery will be available as catalog graph data is expanded.