339098-54-3
Product Name:
5,5-Dimethyl-3-oxo-2-[(phenylsulfonyl)methyl]-1-cyclohexenyl 4-methylbenzenecarboxylate
Formula:
C23H24O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 412.5 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 412.13444504 g/mol |
| Monoisotopic Mass | 412.13444504 g/mol |
| Topological Polar Surface Area | 85.9 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 758 |
| 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 |