CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Brown odorless grains; [MSDSonline] |
|---|---|
| Chemical Classes | Dyes -> Anthraquinone Dyes |
COMPUTED DESCRIPTORS
| Molecular Weight | 474.6 g/mol |
|---|---|
| XLogP3 | 7.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 474.04967004 g/mol |
| Monoisotopic Mass | 474.04967004 g/mol |
| Topological Polar Surface Area | 116 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 744 |
| 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 |