331461-66-6
Product Name:
4-[(4-NITROBENZYL)OXY]BENZYL 3-NITROBENZENECARBOXYLATE
Formula:
C21H16N2O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 408.4 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 408.09575085 g/mol |
| Monoisotopic Mass | 408.09575085 g/mol |
| Topological Polar Surface Area | 127 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 587 |
| 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 |