82039-79-0
Product Name:
3-Benzofurancarboxylic acid, 6-bromo-5-(carboxymethoxy)-2-((phenylthio )methyl)-, 3-ethyl ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 465.3 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 463.99292 g/mol |
| Monoisotopic Mass | 463.99292 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 541 |
| 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 |