Basic information
- Name:
Secnidazole
- CAS No.:
3366-95-8
- Molecular Structure:
- Formula:
- C7H11N3O3
- Molecular Weight:
- 185.18 .
- Synonyms:
- Imidazole-1-ethanol, alpha,2-dimethyl-5-nitro-;PM 185184;Secnidazol [INN-Spanish];1-(2-methyl-5-nitro-imidazol-1-yl)propan-2-ol;1-(2-Methyl-5-nitro-1-imidazolyl)-2-propanol;Secnidazole [BAN:DCF:INN];alpha,2-Dimethyl-5-nitroimidazole-1-ethanol;1-(2-Hydroxypropyl)-2-methyl-5-nitroimidazol;Secnidazolum [INN-Latin];1H-Imidazole-1-ethanol,R,2-dimethyl-5- nitro-;RP 14539;
- EINECS:
- 222-134-0
- Density:
- 1.39 g/cm3
- Melting Point:
- 76 °C
- Boiling Point:
- 396.1 °C at 760 mmHg
- Flash Point:
- 193.4 °C
- Appearance:
- Crystalline solid
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Chemistry
Molecular Formula: C7H11N3O3
Molecular Weight: 185.18
EINECS: 222-134-0
Index of Refraction: 1.597
Density: 1.39 g/cm3
Flash Point: 193.4 °C
Enthalpy of Vaporization: 68.17 kJ/mol
Boiling Point: 396.1 °C at 760 mmHg
Vapour Pressure: 5.49E-07 mmHg at 25 °C
Melting point: 76 °C
Appearance: Crystalline solid
Structure of Secnidazole (CAS NO.3366-95-8):
IUPAC Name: 1-(2-Methyl-5-nitroimidazol-1-yl)propan-2-ol
Canonical SMILES: CC1=NC=C(N1CC(C)O)[N+](=O)[O-]
InChI: InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3
InChIKey: KPQZUUQMTUIKBP-UHFFFAOYSA-N
Product Category of Secnidazole (CAS NO.3366-95-8): Active Pharmaceutical Ingredients;Heterocycles;Intermediates & Fine Chemicals
Uses
Secnidazole (CAS NO.3366-95-8) has been used for analog of metronidazole.
Specification
Secnidazole , its cas register number is 3366-95-8. It also can be called alpha,2-Dimethyl-5-nitro-1H-imidazole-1-ethanol .