6844-77-5
Product Name:
2-Hydroxy-5-[[4'-[[2,6-dihydroxy-3-[(3-sulfophenyl)azo]phenyl]azo]-1,1'-biphenyl-4-yl]azo]benzoic acid disodium salt
Formula:
C31H23N6NaO8S
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COMPUTED DESCRIPTORS
| Molecular Weight | 682.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 7 |
| Exact Mass | 682.08587135 g/mol |
| Monoisotopic Mass | 682.08587135 g/mol |
| Topological Polar Surface Area | 241 Ų |
| Heavy Atom Count | 48 |
| Formal Charge | 0 |
| Complexity | 1180 |
| 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 | 3 |
| Compound Is Canonicalized | Yes |