401615-56-3
Product Name:
2H-1-Benzopyran-2-one, 3-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-
Formula:
C18H12O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 308.3 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 308.06847348 g/mol |
| Monoisotopic Mass | 308.06847348 g/mol |
| Topological Polar Surface Area | 83.8 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 536 |
| 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 |