1049978-74-6
Product Name:
3-Pyrrolidinecarboxylic acid, 4-(3-cyanophenyl)-, (3S,4R)-
Formula:
C12H12N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 216.24 g/mol |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 216.089877630 g/mol |
| Monoisotopic Mass | 216.089877630 g/mol |
| Topological Polar Surface Area | 73.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 320 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |