87095-89-4
Product Name:
trans-1,2-Cyclohexylenedinitrotetraacetic acid hydrate
Formula:
C14H24N2O9
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COMPUTED DESCRIPTORS
| Molecular Weight | 364.35 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 10 |
| Exact Mass | 364.14818035 g/mol |
| Monoisotopic Mass | 364.14818035 g/mol |
| Topological Polar Surface Area | 180 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 477 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |