637749-31-6
Product Name:
2-Thiophenecarboxylic acid, 3-(3-methoxyphenoxy)-2-methyl-4-oxo-4H-1-benzopyran-7-yl ester
Formula:
C22H16O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 408.4 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 408.06675940 g/mol |
| Monoisotopic Mass | 408.06675940 g/mol |
| Topological Polar Surface Area | 99.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 662 |
| 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 |