104567-72-8
Product Name:
4H-1-Benzopyran-4-one, 2-(3,5-dibromo-4-hydroxyphenyl)-6-hydroxy-3-met hyl-
Formula:
C16H10Br2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 426.05 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 425.89253 g/mol |
| Monoisotopic Mass | 423.89458 g/mol |
| Topological Polar Surface Area | 66.8 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 481 |
| 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 |