223916-04-9
Product Name:
7-BROMO-1,2,3,4-TETRAHYDRO-3-(TRIFLUOROMETHYL)-ISOQUINOLINE
Formula:
C10H9BrF3N
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COMPUTED DESCRIPTORS
| Molecular Weight | 280.08 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 278.98705 g/mol |
| Monoisotopic Mass | 278.98705 g/mol |
| Topological Polar Surface Area | 12 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 231 |
| 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 |