66096-14-8
Product Name:
4,4'-BIS[3-CARBOXY-5-OXO-1-(4-SULFOPHENYL)-2-PYRAZOLIN-4-YL]TRIMETHINE OXONOLE DIPOTASSIUM SALT
Formula:
C23H11N4Na4O12S2-
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COMPUTED DESCRIPTORS
| Molecular Weight | 756.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 4 |
| Exact Mass | 755.8441401 g/mol |
| Monoisotopic Mass | 755.8441401 g/mol |
| Topological Polar Surface Area | 276 Ų |
| Heavy Atom Count | 45 |
| Formal Charge | 0 |
| Complexity | 1450 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 5 |
| Compound Is Canonicalized | Yes |