1241680-98-7
Product Name:
(2S)-2-amino-3-[3,5-bis(trifluoromethyl)phenyl]propanoic acid
Formula:
C11H9F6NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 301.18 g/mol |
|---|---|
| XLogP3 | 0.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 301.05374750 g/mol |
| Monoisotopic Mass | 301.05374750 g/mol |
| Topological Polar Surface Area | 63.3 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 332 |
| 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 |