851527-35-0
Product Name:
2-[2-(4-Iodo-phenyl)-2-oxo-ethyl]-malonic acid Diethyl ester
Formula:
C15H17IO5
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COMPUTED DESCRIPTORS
| Molecular Weight | 404.20 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 9 |
| Exact Mass | 404.01207 g/mol |
| Monoisotopic Mass | 404.01207 g/mol |
| Topological Polar Surface Area | 69.7 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 356 |
| 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 |