CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Purple solid; [Merck Index] |
---|---|
Chemical Classes | Dyes -> Azo Dyes |
COMPUTED DESCRIPTORS
Molecular Weight | 440.4 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 4 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 7 |
Exact Mass | 440.07905542 g/mol |
Monoisotopic Mass | 440.07905542 g/mol |
Topological Polar Surface Area | 169 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 775 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 1 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |