930061-65-7
Product Name:
2-((4-Methylphenyl)sulfonyl)-3-(6-nitrobenzo[3,4-d]1,3-dioxolen-5-yl)prop-2-enenitrile
Formula:
C17H12N2O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 372.4 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 372.04160728 g/mol |
| Monoisotopic Mass | 372.04160728 g/mol |
| Topological Polar Surface Area | 131 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 721 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |