EINECS 241-805-9
3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate
Also Known As: EINECS 241-805-9|3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate|1-Ethyl-6-methoxy-2-((5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene)methyl)quinolinium|1-ethyl-6-methoxy-2-[[5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene]methyl]quinoliniu|1-ETHYL-6-METHOXY-2-[[5-METHOXY-3-(3-SULFONATOPROPYL)-3H-BENZOSELENAZOL-2-YLIDENE]METHYL]QUINOLINIUM|1-ethyl-6-methoxy-2-[[5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium|3-{2-[(1-Ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3(2H)-yl}propane-1-sulfonate
| Molecular Formula | C24H26N2O5SSe |
|---|---|
| Molecular Weight | 534.07275 g/mol |
| LogP | 2.25 |
| Topological Polar Surface Area | 82.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 534.07275 |
| Heavy Atoms | 33 |
| Complexity | 1323.9 |
Chemical Identifiers
| CAS Number | 17852-69-6 |
|---|---|
| SMILES | CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C3N(C4=C([Se]3)C=CC(=C4)OC)CCCS(=O)(=O)[O-] |
Product Overview
EINECS 241-805-9 (CAS 17852-69-6), with molecular formula C24H26N2O5SSe and molecular weight 534.07275 g/mol. IUPAC: 3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate.
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