950781-94-9
Product Name:
1,5-Methano-1H-3-benzazepine, 2,3,4,5-tetrahydro-6,8-dinitro-
Formula:
C11H11N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 249.22 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 249.07495584 g/mol |
| Monoisotopic Mass | 249.07495584 g/mol |
| Topological Polar Surface Area | 104 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 378 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |