1086392-54-2
Product Name:
Trifluoro-methanesulfonic acid isoquinolin-8-yl ester
Formula:
C10H6F3NO3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 277.22 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 277.00204871 g/mol |
| Monoisotopic Mass | 277.00204871 g/mol |
| Topological Polar Surface Area | 64.6 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 390 |
| 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 |