1-(2,3-Epoxypropyl)-2-methyl-5-nitroimidazole
Names
[ CAS No. ]:
16773-52-7
[ Name ]:
1-(2,3-Epoxypropyl)-2-methyl-5-nitroimidazole
[Synonym ]:
Imidazole,1-(2,3-epoxypropyl)-2-methyl-5-nitro
3-(2-methyl-5-nitro-1H-imidazolyl)-1,2-epoxypropane
1-(2,3-Epoxypropyl)-2-methyl-5-nitroimidazole
2-methyl-5-nitro-1-oxiranylmethyl-1H-imidazole
1-(2,3-Epoxypropyl)-2-methyl-5-nitroimidazol
2-Methyl-5-nitro-1-(2-oxiranylmethyl)-1H-imidazole
Ornidazole Impurity 1
Chemical & Physical Properties
[ Density]:
1.59g/cm3
[ Boiling Point ]:
395.5ºC at 760mmHg
[ Melting Point ]:
111-112 ºC (ethyl acetate )
[ Molecular Formula ]:
C7H9N3O3
[ Molecular Weight ]:
183.16500
[ Flash Point ]:
193ºC
[ Exact Mass ]:
183.06400
[ PSA ]:
76.17000
[ LogP ]:
1.02170
[ Vapour Pressure ]:
4.18E-06mmHg at 25°C
[ Index of Refraction ]:
1.684
[ Storage condition ]:
2-8°C
[ Water Solubility ]:
Slightly soluble (3.3 g/L) (25 ºC)
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NI5300000
- CHEMICAL NAME :
- Imidazole, 1-(2,3-epoxypropyl)-2-methyl-5-nitro-
- CAS REGISTRY NUMBER :
- 16773-52-7
- BEILSTEIN REFERENCE NO. :
- 0613771
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H9-N3-O3
- MOLECULAR WEIGHT :
- 183.19
- WISWESSER LINE NOTATION :
- T5N CNJ B1 ENW A1- BT3OTJ
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1414 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 17,1019,1974
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 17,1019,1974