900014-97-3
Product Name:
4-((E)-2-CYANO-3-[2-(TRIFLUOROMETHYL)PHENYL]-2-PROPENOYL)BENZENECARBONITRILE
Formula:
C18H9F3N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 326.3 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 326.06669740 g/mol |
| Monoisotopic Mass | 326.06669740 g/mol |
| Topological Polar Surface Area | 64.6 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 597 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |