1807291-49-1
Product Name:
Benzoic acid, 3-cyano-5-hydroxy-2-methoxy-, methyl ester
Formula:
C10H9NO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 207.18 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 207.05315777 g/mol |
| Monoisotopic Mass | 207.05315777 g/mol |
| Topological Polar Surface Area | 79.6 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 282 |
| 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 |