ChemicalBook--->CAS DataBase List--->705-19-1

705-19-1

705-19-1 Structure

705-19-1 Structure
IdentificationBack Directory
[Name]

2-(2-METHYL-4-NITRO-IMIDAZOL-1-YL)-ETHANOL
[CAS]

705-19-1
[Synonyms]

RP 8979
M002006
Izoklion
Isometronidazol
isometronidazole
Metronidazole Impurity81
Metronidazole Impurity36
Isometronidazole, Izoklion
Metronidazole EP Impurity E
Metronidazole impurity E (EP)
ISOMETRONIDAZOLE-D4 HYDROCHLORIDE
2-Methyl-4-nitroimidazole-1-ethanol
Imidazole-1-ethanol, 2-methyl-4-nitro-
2-Methyl-4-nitro-1H-imidazole-1-ethanol
2-(2-Methyl-4-nitro-1-imidazolyl)ethanol
1H-Imidazole-1-ethanol,2-methyl-4-nitro-
2-(2-METHYL-4-NITRO-IMIDAZOL-1-YL)-ETHANOL
1-(2-Hydroxyethyl)-2-methyl-4-nitroimidazole
2-(2-methyl-4-nitro-1H-imidazol-1-yl)ethanol
2-(2-methyl-4-nitro-1H-imidazol-1-yl)ethan-1-ol
Metronidazole Impurity 5(Metronidazole EP Impurity E)
Imp. E (EP):2-(2-Methyl-4-nitro-1Himidazol-1-yl)ethanol
Metronidazole impurity 3/Metronidazole EP impurity E/2-(2-methyl-4-nitro-1H-imidazol-1-yl)ethan-1-ol
[Molecular Formula]

C6H9N3O3
[MDL Number]

MFCD00196022
[MOL File]

705-19-1.mol
[Molecular Weight]

171.15
Chemical PropertiesBack Directory
[Melting point ]

140 °C
[Boiling point ]

405.4±25.0 °C(Predicted)
[density ]

1.45±0.1 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

14.44±0.10(Predicted)
[color ]

Off-White to Orange
[Major Application]

pharmaceutical
[InChI]

1S/C6H9N3O3/c1-5-7-6(9(11)12)4-8(5)2-3-10/h4,10H,2-3H2,1H3
[InChIKey]

RSXWJXPKLRYMHW-UHFFFAOYSA-N
[SMILES]

[N+](=O)([O-])c1nc([n](c1)CCO)C
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Isometronidazole (Metronidazole EP Impurity E) is an impurity of Metronidazole (M338880), a chemotherapeutic agent that is used as a first line defense against Clostridium difficile (C.diff). Isometronidazole is also a hypoxic cell sensitizer in humans and mice.
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