251310-66-4
Product Name:
1,1,1,5,5,5-HEXAFLUORO-3-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-2,4-PENTANEDIONE
Formula:
C14H11F6NO2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 339.23 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 339.06939757 g/mol |
| Monoisotopic Mass | 339.06939757 g/mol |
| Topological Polar Surface Area | 46.2 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 447 |
| 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 |