Isoquinoline, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2,3,6,7-tetramethyl-, hydrochloride
1-[2-(4-chlorophenyl)ethyl]-2,3,6,7-tetramethyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
| Molecular Formula | C21H27Cl2N |
|---|---|
| Molecular Weight | 364.3 g/mol |
| Topological Polar Surface Area | 4.4 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.15207 |
| Heavy Atoms | 24 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 63937-87-1 |
|---|---|
| SMILES | CC1CC2=C(C=C(C(=C2)C)C)C([NH+]1C)CCC3=CC=C(C=C3)Cl.[Cl-] |
| InChIKey | XMNLGWOTBAOGKU-UHFFFAOYSA-N |
📖 Product Overview
Isoquinoline, 1,2,3,4-tetrahydro-1-(4-chlorophenethyl)-2,3,6,7-tetramethyl-, hydrochloride (CAS: 63937-87-1) is a chemical compound with molecular formula C21H27Cl2N and molecular weight 364.3 g/mol. Its IUPAC systematic name is 1-[2-(4-chlorophenyl)ethyl]-2,3,6,7-tetramethyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride.
XMNLGWOTBAOGKU-UHFFFAOYSA-N.
SMILES: CC1CC2=C(C=C(C(=C2)C)C)C([NH+]1C)CCC3=CC=C(C=C3)Cl.[Cl-].
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