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N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-(trifluoromethyl)-D-phenylalanine(CAS: 82317-83-7)

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-(trifluoromethyl)-D-phenylalanine
CAS Number

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Basic Information

Molecular Formula
C15H18F3NO4
Molecular Weight
333.31 g/mol

Physical Properties

Melting Point
135-140 ºC
Boiling Point
431.41°C/760mmHg
Density
1.2700
Flash Point
214.7 °C

Chemical Identifiers

SMILES
CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C(F)(F)F)C(=O)O
InChIKey
SMVCCWNHCHCWAZ-LLVKDONJSA-N

Database References

MDL Number
MFCD00797557

FAQ

This compound is a solid with a crystalline form. It has a high molecular weight due to its complex structure. The compound is poorly soluble in water but more soluble in organic solvents like dichloromethane and acetonitrile. It shows limited reactivity but can undergo ester hydrolysis under basic conditions. Its solubility and reactivity make it useful in certain synthetic processes and pharmaceutical applications.
This compound is synthesized via a multi-step process that includes protection of the D-phenylalanine, introduction of the trifluoromethyl group, and formation of the ester linkage. Commonly used catalysts include esters of carboxylic acids. The synthesis typically yields high purity products with good selectivity and yield, making it suitable for commercial production.
This compound is primarily used in the pharmaceutical industry, particularly in the development of anti-inflammatory drugs. It also finds applications in the polymer industry for the synthesis of high-performance polymers, and in the semiconductor industry for the production of organic light-emitting diodes (OLEDs).
When handling this compound, appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. Work should be conducted in a well-ventilated environment or a fume hood. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Safety data sheets (SDS) should be consulted for detailed handling instructions and emergency procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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