35013-90-2
Product Name:
4-[CYANO(HYDROXYAMINO)METHYL]-1-METHYLPYRIDINIUM IODIDE
Formula:
C8H8IN3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 289.07 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 288.97121 g/mol |
| Monoisotopic Mass | 288.97121 g/mol |
| Topological Polar Surface Area | 60.3 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 220 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |