Ornidazole, (R)-
Basic information
- CAS
166734-80-1- Standard SMILES
Cc1ncc([N+](=O)[O-])n1C[C@@H](O)CCl- InChIKey
IPWKIXLWTCNBKN-LURJTMIESA-N- Molecular formula
- C7H10ClN3O3
- Average molar mass
- 219.62 g/mol
Names & identifiers
- Preferred name
- Ornidazole, (R)-
- IUPAC
- (2R)-1-chloro-3-(2-methyl-5-nitroimidazol-1-yl)propan-2-ol
- English name
- (R)-Ornidazole
- Molecular formula
- C7H10ClN3O3
- Molecular weight
- 219.63
Names & synonyms
166734-80-1UNII-F3QC8V74EC(+)-TiberalOrnidazole, (R)-Ornidazole, (+)-F3QC8V74EC1H-Imidazole-1-ethanol, alpha-(chloromethyl)-2-methyl-5-nitro-, (alphaR)-1H-IMIDAZOLE-1-ETHANOL, .ALPHA.-(CHLOROMETHYL)-2-METHYL-5-NITRO-, (.ALPHA.R)-RefChem:202432(R)-Ornidazole(2R)-1-chloro-3-(2-methyl-5-nitroimidazol-1-yl)propan-2-ol(R)-1-Chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol
Show more names
R-ornidaoleOrnidazole Impurity 8Ornidazole Impurity 8（(R)-Ornidazole）Disodium phosphate levononidazole ester impurity APhosphoric acid levononidazole ester disodium impurity A1H-Imidazole-1-ethanol, α-(chloromethyl)-2-methyl-5-nitro-, (αR)-
Ornidazole Impurity 12D-OrnidazoleSCHEMBL15158379SCHEMBL18978151EBC-08679PD132367EN300-20060398(2R)-1-chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol
Database identifiers
- CAS
166734-80-1- PubChem CID
- 688540
- UNII
- F3QC8V74EC
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 83.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 211
Physicochemical properties
- Boiling point
- 443.2 · 443.2±40.0 °C(Predicted)
- Density
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- pka
- 13.29 · 13.29±0.20(Predicted)
- FDA UNII
- 3 QC8V74EC · F3QC8V74EC
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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