306979-86-2
Product Name:
5-ACETYL-2-(BUTYLAMINO)-6-METHYLNICOTINONITRILE
Formula:
C13H17N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 231.29 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 231.137162174 g/mol |
| Monoisotopic Mass | 231.137162174 g/mol |
| Topological Polar Surface Area | 65.8 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 307 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |