68298-91-9
Product Name:
4-[(3-Hydroxy-1-oxo-2-butenyl)amino]-1-naphthalenesulfonic acid
Formula:
C14H13NO5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 307.32 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 307.05144369 g/mol |
| Monoisotopic Mass | 307.05144369 g/mol |
| Topological Polar Surface Area | 112 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 522 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |