339030-16-9
Product Name:
2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-PHENYLPENTANEDINITRILE
Formula:
C17H11ClF3N3
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COMPUTED DESCRIPTORS
| Molecular Weight | 349.7 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 349.0593595 g/mol |
| Monoisotopic Mass | 349.0593595 g/mol |
| Topological Polar Surface Area | 60.5 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 526 |
| Isotope Atom Count | 0 |
| 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 |