1049734-61-3
Product Name:
3-Pyrrolidinecarboxylic acid, 4-[2-(trifluoromethyl)phenyl]-, hydrochloride (1:1), (3S,4R)-
Formula:
C12H12F3NO2.ClH
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COMPUTED DESCRIPTORS
| Molecular Weight | 295.68 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 295.0586908 g/mol |
| Monoisotopic Mass | 295.0586908 g/mol |
| Topological Polar Surface Area | 49.3 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 319 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |