850411-11-9
Product Name:
Z-[2-BROMO-4-(2-PYRIDIN-3-YL-VINYL)-PHENOXY]-ACETIC ACID TERT-BUTYL ESTER
Formula:
C19H20BrNO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 390.3 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 7 |
| Exact Mass | 389.06266 g/mol |
| Monoisotopic Mass | 389.06266 g/mol |
| Topological Polar Surface Area | 48.4 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 433 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |