1805247-83-9
Product Name:
Benzeneacetic acid, 3-bromo-4-cyano-5-hydroxy-, ethyl ester
Formula:
C11H10BrNO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 284.11 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 282.98441 g/mol |
| Monoisotopic Mass | 282.98441 g/mol |
| Topological Polar Surface Area | 70.3 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 299 |
| 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 |