93798-31-3
Product Name:
Benzoic acid, 3-(2,5,7-tribromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)-
Formula:
C20H9Br3O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 569.0 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 567.79796 g/mol |
| Monoisotopic Mass | 565.80001 g/mol |
| Topological Polar Surface Area | 83.8 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 802 |
| 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 |