887922-89-6
Product Name:
2-PYRROLIDIN-1-YLISONICOTINIC ACID, 1.5 HYDRATE
Formula:
C10H12N2O2.H2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 210.23 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 210.10044231 g/mol |
| Monoisotopic Mass | 210.10044231 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 214 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |