84006-52-0
Product Name:
2-((2-Cyano-3-phenyl-1-oxo-2-propenyl)oxy)-1-methylpropyl undecanoate
Formula:
C25H35NO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 413.5 g/mol |
|---|---|
| XLogP3 | 7.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 16 |
| Exact Mass | 413.25660860 g/mol |
| Monoisotopic Mass | 413.25660860 g/mol |
| Topological Polar Surface Area | 76.4 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 583 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |