303146-27-2
Product Name:
5-ACETYL-6-METHYL-2-(PROPYLSULFANYL)NICOTINONITRILE
Formula:
C12H14N2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 234.32 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 234.08268425 g/mol |
| Monoisotopic Mass | 234.08268425 g/mol |
| Topological Polar Surface Area | 79 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 297 |
| 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 |