6,7-dimethyl-5-(2-methylhexan-2-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
6,7-dimethyl-5-(2-methylhexan-2-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride
| Molecular Formula | C19H30ClNO2 |
|---|---|
| Molecular Weight | 339.9 g/mol |
| Topological Polar Surface Area | 22.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.1965 |
| Heavy Atoms | 23 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 19409-90-6 |
|---|---|
| SMILES | CCCCC(C)(C)C1C2=CC3=C(C=C2CC([NH+]1C)C)OCO3.[Cl-] |
| InChIKey | IIPQYFLHVXWNQN-UHFFFAOYSA-N |
📖 Product Overview
6,7-dimethyl-5-(2-methylhexan-2-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride (CAS: 19409-90-6) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.9 g/mol. Its IUPAC systematic name is 6,7-dimethyl-5-(2-methylhexan-2-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride.
IIPQYFLHVXWNQN-UHFFFAOYSA-N.
SMILES: CCCCC(C)(C)C1C2=CC3=C(C=C2CC([NH+]1C)C)OCO3.[Cl-].
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