690678-46-7
Product Name:
2-(4-BUTYL-6-CHLORO-2-OXO-2H-CHROMEN-7-YLOXY)-PROPIONIC ACID
Formula:
C16H17ClO5
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COMPUTED DESCRIPTORS
| Molecular Weight | 324.75 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 324.0764513 g/mol |
| Monoisotopic Mass | 324.0764513 g/mol |
| Topological Polar Surface Area | 72.8 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 462 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |