339101-92-7
Product Name:
3-([(4-CHLOROPHENYL)SULFONYL]METHYL)-4-NITROBENZENECARBONITRILE
Formula:
C14H9ClN2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 336.8 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 335.9971556 g/mol |
| Monoisotopic Mass | 335.9971556 g/mol |
| Topological Polar Surface Area | 112 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 552 |
| 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 |