500770-77-4
Product Name:
(S)-BOC-2-(TRIFLUOROMETHYL)-BETA-PHE-OH
Formula:
C15H18F3NO4
Synonyms:
(S)-3-(Boc-amino)-3-[2-(trifluoromethyl)phenyl]propionic acid;Boc-2-(trifluormethyl)-D -β-phenylalanine
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COMPUTED DESCRIPTORS
| Molecular Weight | 333.30 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 333.11879254 g/mol |
| Monoisotopic Mass | 333.11879254 g/mol |
| Topological Polar Surface Area | 75.6 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 431 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |