Base information
| Cat. No. | |
| CAS No. | 15876-58-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C60H6Al2Br12Cl12O15 |
| Molecular Weight | 2404.93 |
| Exact Mass | 2386.58 |
| XLogP3 | 26.2071 |
| Mr | 421.595 |
| PSA | 280.2 |
| Sequence | - |
| Atom number | 107 |
| Bond number | 114 |
| Ring number | 12 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | Clc1c(Cl)c(Cl)c(c(c1Cl)C(=O)[O-])c1c2-c(oc3c1cc(Br)c(c3Br)[O-])c(c(=O)c(c2)Br)Br.Clc1c(Cl)c(Cl)c(c(c1Cl)C(=O)[O-])c1c2-c(oc3c1cc(Br)c(c3Br)[O-])c(c(=O)c(c2)Br)Br.Clc1c(Cl)c(Cl)c(c(c1Cl)C(=O)[O-])c1c2-c(oc3c1cc(Br)c(c3Br)[O-])c(c(=O)c(c2)Br)Br.[Al+3].[Al+3] |
