Diphenylmethyl(benzoyl-alpha-tropinium) bromid [German]
[(1R,5S)-8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] benzoate bromide
Also Known As: KST-1A0582|N 361|Diphenylmethyl(benzoyl-alpha-tropinium) bromid|Diphenylmethyl(benzoyl-alpha-tropinium) bromid [German]|Tropinium, 8-(p-phenylbenzyl)-, bromide, benzoate|(1r,5s)-3-(benzoyloxy)-8-(biphenyl-4-ylmethyl)-8-methyl-8-azoniabicyclo[3.2.1]octane bromide|[(1R,5S)-8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] benzoate bromide
| Molecular Formula | C28H30BrNO2 |
|---|---|
| Molecular Weight | 491.146 g/mol |
| LogP | 2.85 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 491.146 |
| Heavy Atoms | 32 |
| Complexity | 1022.0 |
Chemical Identifiers
| CAS Number | 1107-18-2 |
|---|---|
| SMILES | C[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5.[Br-] |
Product Overview
Diphenylmethyl(benzoyl-alpha-tropinium) bromid [German] (CAS 1107-18-2), with molecular formula C28H30BrNO2 and molecular weight 491.146 g/mol. IUPAC: [(1R,5S)-8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] benzoate bromide.
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