1189704-85-5
Product Name:
2-(3-CHLOROPHENYL)-2-CYANO-1-(3-PYRIDINYL-D4)-1-ETHANONE
Formula:
C14H5ClD4N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 260.71 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 260.0654476 g/mol |
| Monoisotopic Mass | 260.0654476 g/mol |
| Topological Polar Surface Area | 53.8 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 349 |
| Isotope Atom Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |