RefChem:1073860
(3S)-6-chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Also Known As: RefChem:1073860|AC1L20Z1|Isoquinoline, 1,2,3,4-tetrahydro-6-chloro-2,3-dimethyl-4-phenyl-, hydrochloride, (E)-|Isoquinoline, 6-chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydro-, hydrochloride, (E)-|trans-6-Chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline hydrochloride|(3S)-6-Chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-iumchloride|(3S)-6-chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride|6-Chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)|Isoquinoline, 6-chloro-1,2,3,4-tetrahydro-2,3-dimethyl-4-phenyl-, hydrochloride, trans-
| Molecular Formula | C17H19Cl2N |
|---|---|
| Molecular Weight | 307.08945 g/mol |
| LogP | -0.11 |
| Topological Polar Surface Area | 4.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.08945 |
| Heavy Atoms | 20 |
| Complexity | 582.8 |
Chemical Identifiers
| CAS Number | 41958-58-1 |
|---|---|
| SMILES | C[C@H]1C(C2=C(C[NH+]1C)C=CC(=C2)Cl)C3=CC=CC=C3.[Cl-] |
Product Overview
RefChem:1073860 (CAS 41958-58-1), with molecular formula C17H19Cl2N and molecular weight 307.08945 g/mol. IUPAC: (3S)-6-chloro-2,3-dimethyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride.
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