BENZOFURAZAN, 4,7-BIS((4-METHYLPHENYL)SULFONYL)-, 1-OXIDE
4,7-bis-(4-methylphenyl)sulfonyl-3-oxido-2,1,3-benzoxadiazol-3-ium
| Molecular Formula | C20H16N2O6S2 |
|---|---|
| Molecular Weight | 444.5 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 137.0 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.04498 |
| Heavy Atoms | 30 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 53619-79-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C3=[N+](ON=C23)[O-])S(=O)(=O)C4=CC=C(C=C4)C |
| InChIKey | KYPKSNSADFFYFW-UHFFFAOYSA-N |
📖 Product Overview
BENZOFURAZAN, 4,7-BIS((4-METHYLPHENYL)SULFONYL)-, 1-OXIDE (CAS: 53619-79-7) is a chemical compound with molecular formula C20H16N2O6S2 and molecular weight 444.5 g/mol. Its IUPAC systematic name is 4,7-bis-(4-methylphenyl)sulfonyl-3-oxido-2,1,3-benzoxadiazol-3-ium.
KYPKSNSADFFYFW-UHFFFAOYSA-N.
SMILES: CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C3=[N+](ON=C23)[O-])S(=O)(=O)C4=CC=C(C=C4)C.
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