94129-35-8
Product Name:
2,4-Pentanedione, 3-(2-acetyl-1,2-dihydro-1-isoquinolinyl)-
Formula:
C16H17NO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 271.31 g/mol |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 271.12084340 g/mol |
| Monoisotopic Mass | 271.12084340 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 441 |
| 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 |