RefChem:319127
(2-benzoyloxycyclohexyl)methyl-[2-[4-[2-[(2-benzoyloxycyclohexyl)methyl-dimethylazaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide
Also Known As: AC1L1QXX|RefChem:319127|Ammonium, (terephthaloyldimethylene)bis(((2-hydroxycyclohexyl)methyl)dimethyl-, dibromide, dibenzoate|(2-benzoyloxycyclohexyl)methyl-[2-[4-[2-[(2-benzoyloxycyclohexyl)methyl-dimethylazaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide|AMMONIUM, (TEREPHTHALOYLDIMETHYLENE)BIS(((2-HYDROXYCYCLOHEXYL)METHYL)DIMETHYL-,|2,2'-(1,4-Phenylene)bis(N-{[2-(benzoyloxy)cyclohexyl]methyl}-N,N-dimethyl-2-oxoethan-1-aminium) dibromide
| Molecular Formula | C42H54Br2N2O6 |
|---|---|
| Molecular Weight | 840.23486 g/mol |
| LogP | 1.04 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 842.2328 |
| Heavy Atoms | 52 |
| Complexity | 1493.9 |
Chemical Identifiers
| CAS Number | 28003-39-6 |
|---|---|
| SMILES | C[N+](C)(CC1CCCCC1OC(=O)C2=CC=CC=C2)CC(=O)C3=CC=C(C=C3)C(=O)C[N+](C)(C)CC4CCCCC4OC(=O)C5=CC=CC=C5.[Br-].[Br-] |
Product Overview
RefChem:319127 (CAS 28003-39-6), with molecular formula C42H54Br2N2O6 and molecular weight 840.23486 g/mol. IUPAC: (2-benzoyloxycyclohexyl)methyl-[2-[4-[2-[(2-benzoyloxycyclohexyl)methyl-dimethylazaniumyl]acetyl]phenyl]-2-oxoethyl]-dimethylazanium dibromide.
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