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Product Name:
2-(7-NITRO-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-2-YL)ETHYL 3-NITROBENZENECARBOXYLATE
Formula:
C17H13N3O8
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COMPUTED DESCRIPTORS
| Molecular Weight | 387.3 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 387.07026438 g/mol |
| Monoisotopic Mass | 387.07026438 g/mol |
| Topological Polar Surface Area | 156 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 631 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |