898757-17-0
Product Name:
5-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)-3'-IODO-4'-METHYLVALEROPHENONE
Formula:
C18H25IO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 416.3 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 416.08484 g/mol |
| Monoisotopic Mass | 416.08484 g/mol |
| Topological Polar Surface Area | 35.5 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 359 |
| 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 |