303994-64-1
Product Name:
5-(TERT-BUTYL)-2-([4-(TRIFLUOROMETHYL)BENZYL]OXY)ISOPHTHALONITRILE
Formula:
C20H17F3N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 358.4 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 358.12929766 g/mol |
| Monoisotopic Mass | 358.12929766 g/mol |
| Topological Polar Surface Area | 56.8 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 543 |
| 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 |