Metilsulfato de tematropio
1-O-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-O-ethyl 2-phenylpropanedioate;methyl sulfate
Also Known As: Tematropium|hgp-6|Tematropium metilsulfate|TEMATROPIUM METHYLSULFATE|Tematropium metilsulphate|AC1L1TLK|Tematropium methylsulphate|Metilsulfato de tematropio|Metilsulfate de tematropium|AC1Q22SD|CDDD 3602|CDDD-3602|1-O-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-O-ethyl 2-phenylpropanedioate; methyl sulfate|3-[(3-Ethoxy-3-oxo-2-phenylpropanoyl)oxy]-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium methyl sulfate
| Molecular Formula | C21H31NO8S |
|---|---|
| Molecular Weight | 457.17703 g/mol |
| LogP | 1.74 |
| Topological Polar Surface Area | 119.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 457.17703 |
| Heavy Atoms | 31 |
| Complexity | 839.4 |
Chemical Identifiers
| CAS Number | 113932-41-5 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC=CC=C1)C(=O)OC2CC3CCC(C2)[N+]3(C)C.COS(=O)(=O)[O-] |
Product Overview
Metilsulfato de tematropio (CAS 113932-41-5), with molecular formula C21H31NO8S and molecular weight 457.17703 g/mol. IUPAC: 1-O-(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 3-O-ethyl 2-phenylpropanedioate;methyl sulfate.
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