112404-27-0
Product Name:
2-(2-(4-BROMOPHENYL)-2-OXOETHYL)-5,5-DIMETHYLCYCLOHEXANE-1,3-DIONE
Formula:
C16H17BrO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 337.21 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 336.03611 g/mol |
| Monoisotopic Mass | 336.03611 g/mol |
| Topological Polar Surface Area | 51.2 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 399 |
| 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 |