14816-17-2
Product Name:
3,5-DIOXA-6-AZA-4-PHOSPHAOCT-6-ENE-8-NITRILE, 4-ETHOXY-7-PHENYL-, 4-OXIDE
Formula:
C12H15N2O4P
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COMPUTED DESCRIPTORS
| Molecular Weight | 282.23 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 282.07694396 g/mol |
| Monoisotopic Mass | 282.07694396 g/mol |
| Topological Polar Surface Area | 80.9 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 386 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |