32801-22-2
Product Name:
3-Cyano-4-trifluoromethyl-6-(4''-bromophenyl)pyridine-2-one
Formula:
C13H6BrF3N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 343.10 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 341.96156 g/mol |
| Monoisotopic Mass | 341.96156 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 534 |
| 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 |