339023-21-1
Product Name:
3-Acetyl-4-[(4-methylphenyl)sulfonyl]-2,5-dihydro-1H-1lambda6-thiophene-1,1-dione
Formula:
C13H14O5S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 314.4 g/mol |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 314.02826589 g/mol |
| Monoisotopic Mass | 314.02826589 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 636 |
| 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 |