2-(2-(Dideuterio(hydroxy)methyl)-5-nitroimidazol-1-yl)ethanol
CAS: 2196180-19-3
| 1 | 2-(2-(Dideuterio(hydroxy)methyl)-5-nitroimidazol-1-yl)ethanol |
| 2 | 2-[2-[dideuterio(hydroxy)methyl]-5-nitroimidazol-1-yl]ethanol |
| 3 | RefChem:453088 |
| 4 | 881-463-3 |
| 5 | Metronidazole-hydroxy D2 |
No description available for this item
| Molecular Formula | C6H9N3O4 |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 189.1700 |
| InChIKey | AEHPOYAOLCAMIU-APZFVMQVSA-N |
| InChI | InChI=1S/C6H9N3O4/c10-2-1-8-5(4-11)7-3-6(8)9(12)13/h3,10-11H,1-2,4H2/i4D2 |
| XLogP | -1.3000 |
| ExactMass | 189.0719 |
| MonoisotopicMass | 189.0719 |
| TPSA | 104.0000 |
| Complexity | 183.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 2 |
| HBondAcceptorCount | 5 |
| RotatableBondCount | 3 |
| HeavyAtomCount | 13 |
| IsotopeAtomCount | 2 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 0 |
| PatentFamilyCount | 0 |
| LiteratureCount | 0 |