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Chemical Absolute Identifiers
CAS Number
1993286-79-5
PubChem CID
121604962
Molecular Formula
C15H16F3NO2
Molecular Weight
299.29 g/mol
Exact Mass
299.113313
InChIKey
ABJLVYBEEDJSKD-LMWSTFAQSA-N
IUPAC Name
benzyl (2S)-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
Physical Properties
Appearance
white crystalline solid
Physical State
solid
Melting Point
120.0 °C
Boiling Point
350.0 °C
Density
1.3 g/cm³
Water Solubility
slightly soluble
Flash Point
194.2 °C
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog Facts
Structural features
This is a chiral amino acid derivative featuring a benzyl ester and a trifluoromethyl-substituted bicyclo[1.1.1]pentane moiety. It is primarily intended for research and development in synthetic organic chemistry and...
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Primarily used as a chiral building block in synthetic organic chemistry, particularly in medicinal chemistry for the synthesis of novel drug candidates, peptidomimetics, and other bioactive molecules. Suitable for...
Documentation needs
COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.
Applications & Classification
Safety & Handling
Handling and Storage
- Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Refer to the Safety Data Sheet (SDS) for comprehensive safety information and emergency procedures. Store in a cool, dry place, tightly sealed.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
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