53904-41-9
Product Name:
4-(4-methylphenyl)-1-oxo-1H-isochromene-3-carboxylic acid
Formula:
C17H12O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 280.27 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 280.07355886 g/mol |
| Monoisotopic Mass | 280.07355886 g/mol |
| Topological Polar Surface Area | 63.6 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 471 |
| 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 |