898757-15-8
Product Name:
4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)-3'-IODO-4'-METHYLBUTYROPHENONE
Formula:
C17H23IO3
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COMPUTED DESCRIPTORS
Molecular Weight | 402.27 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 5 |
Exact Mass | 402.06919 g/mol |
Monoisotopic Mass | 402.06919 g/mol |
Topological Polar Surface Area | 35.5 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 346 |
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 |