5-methyl-2-nitro-1H-imidazole

CAS No. 5213-35-4

Formula: C4H5N3O2
Basic Info

Formula
C4H5N3O2
Molecular Weight
127.101
Exact Mass
127.038
LogP
1.1495
PSA
74.5
Synonyms

METHYLNITROIMIDAZOLE

IMIDAZOLE,4-METHYL-2-NITRO-,mixed with 5-METHYL-2-NITROIMIDAZOLE (1:1)

4-Methyl-2-nitroimidazole

Imidazole,5-methyl-2-nitro-,mixed with 4-methyl-2-nitroimidazole (1:1)

1H-Imidazole,4-methyl-2-nitro

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Properties
Density
1.426g/cm3
Boiling Point
362.4ºC at 760 mmHg
Flash Point
173ºC
Refractive Index
1.591
Safety Info
HS Code
2933290090
Spectrum
NMR Spectrum 1H NMR : Predict
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Synthesis Route
1.Synthesis Route
Precursor
Downstream Product
Toxicity
ACUTE TOXICITY DATA
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Type of Test
LD50 - Lethal dose, 50 percent kill
Exposure Route
Oral
Species Observed
Rodent - mouse
Dose/Duration
152 mg/kg
Toxic Effects
Details of toxic effects not reported other than lethal dose value--
Reference
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: 12,775,1969
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