856095-68-6
Product Name:
O-Pyruvoylsalicylic acid hydrate
Formula:
C10H8O5
Synonyms:
2-(1,2-Dioxopropoxy)benzoic acid hydrate;O-Pyruvoylsalicylic acid hydrate
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COMPUTED DESCRIPTORS
| Molecular Weight | 208.17 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 208.03717335 g/mol |
| Monoisotopic Mass | 208.03717335 g/mol |
| Topological Polar Surface Area | 80.7 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 284 |
| 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 |