49568-47-0
Product Name:
Diethyl 4,4’-Disulfanediylbis(3-nitrobenzoate)
Formula:
C18H16N2O8S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 452.5 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 9 |
| Exact Mass | 452.03480782 g/mol |
| Monoisotopic Mass | 452.03480782 g/mol |
| Topological Polar Surface Area | 195 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 585 |
| 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 |