6054-91-7
Product Name:
5-Chloro-3-[[1-(2-chloro-4-sulfophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-2-hydroxybenzenesulfonic acid disodium salt
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COMPUTED DESCRIPTORS
| Molecular Weight | 567.3 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 4 |
| Exact Mass | 565.9112496 g/mol |
| Monoisotopic Mass | 565.9112496 g/mol |
| Topological Polar Surface Area | 209 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 997 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |