28495-11-6
Product Name:
(3,5-DIBROMO-2-HYDROXY-4-METHOXY-PHENYL)-ACETONITRILE
Formula:
C9H7Br2NO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 320.96 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 320.88230 g/mol |
| Monoisotopic Mass | 318.88435 g/mol |
| Topological Polar Surface Area | 53.2 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 240 |
| 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 |