RefChem:329191
[3-[[2-(diethylamino)ethyl-methylamino]methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 3,4,5-trimethoxybenzoate;dihydrochloride
Also Known As: 2-Bornanol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-, 3,4,5-trimethoxybenzoate, 2HCl|Bicyclo(2.2.1)heptan-2-ol, 3-(((2-(diethylamino)ethyl)methylamino)methyl)-1,7,7-trimethyl-, 3,4,5-trimethoxybenzoate (ester), dihydrochloride|[2-[[2-diethylaminoethyl(methyl)amino]methyl]-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 3,4,5-trimethoxybenzoate dihydrochloride|3-({[2-(Diethylamino)ethyl](methyl)amino}methyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 3,4,5-trimethoxybenzoate--hydrogen chloride (1/2)
| Molecular Formula | C28H48Cl2N2O5 |
|---|---|
| Molecular Weight | 562.294 g/mol |
| LogP | 5.4273 |
| Topological Polar Surface Area | 60.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 562.294 |
| Monoisotopic Mass | 562.294 |
| Heavy Atoms | 37 |
| Complexity | 685.0 |
Chemical Identifiers
| CAS Number | 17092-63-6 |
|---|---|
| SMILES | CCN(CC)CCN(C)CC1C2CCC(C1OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)(C2(C)C)C.Cl.Cl |
| InChIKey | OCGRKDHXZHGXEP-UHFFFAOYSA-N |
Product Overview
RefChem:329191 (CAS 17092-63-6), with molecular formula C28H48Cl2N2O5 and molecular weight 562.294 g/mol. IUPAC: [3-[[2-(diethylamino)ethyl-methylamino]methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 3,4,5-trimethoxybenzoate;dihydrochloride.
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