331460-88-9
Product Name:
4-[3-(1,3-BENZODIOXOL-5-YL)ACRYLOYL]PHENYL 4-CHLOROBENZENESULFONATE
Formula:
C22H15ClO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 442.9 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 442.0277871 g/mol |
| Monoisotopic Mass | 442.0277871 g/mol |
| Topological Polar Surface Area | 87.3 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 716 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |