Methyl5-(1-pyrrolidinyl)-2-pyrazinecarboxylate
(9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) (2S)-3-hydroxy-2-phenylpropanoate;trihydrate;hydrobromide
Also Known As: Scopolamine hydrobromide|Methyl5-(1-pyrrolidinyl)-2-pyrazinecarboxylate|(9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) (2S)-3-hydroxy-2-phenylpropanoate;trihydrate;hydrobromide
CAS: 6533-68-2
| Molecular Formula | C17H28BrNO7 |
|---|---|
| Molecular Weight | 437.10492 g/mol |
| LogP | -0.9781 |
| Topological Polar Surface Area | 156.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.10492 |
| Monoisotopic Mass | 437.10492 |
| Heavy Atoms | 26 |
| Complexity | 557.4896 |
Chemical Identifiers
| CAS Number | 6533-68-2 |
|---|---|
| SMILES | CN1C2CC(CC1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4.O.O.O.Br |
Product Overview
Methyl5-(1-pyrrolidinyl)-2-pyrazinecarboxylate (CAS 6533-68-2), with molecular formula C17H28BrNO7 and molecular weight 437.10492 g/mol. IUPAC: (9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl) (2S)-3-hydroxy-2-phenylpropanoate;trihydrate;hydrobromide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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