| 1 | RefChem:1086498 |
| 2 | BR 33N |
| 3 | DTXSID6024129 |
| 4 | 9346I1RE5F |
| 5 | DTXCID701323313 |
No description available for this item
| Molecular Formula | C12H4Br6O |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 643.6000 |
| InChIKey | HRSCBOSGEKXXSI-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H4Br6O/c13-5-1-7(15)11(8(16)2-5)19-12-9(17)3-6(14)4-10(12)18/h1-4H |
| XLogP | 7.6000 |
| ExactMass | 643.5301 |
| MonoisotopicMass | 637.5362 |
| TPSA | 9.2000 |
| Complexity | 252.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 1 |
| RotatableBondCount | 2 |
| HeavyAtomCount | 19 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 88 |
| PatentFamilyCount | 37 |
| LiteratureCount | 86 |