2,4-Dinitroimidazole - CAS 5213-49-0

Catalog: BB027727
Product Name: 2,4-Dinitroimidazole
CAS: 5213-49-0
Synonyms: 2,5-dinitro-1H-imidazole; 2,5-dinitro-1H-imidazole
2,4-Dinitroimidazole
IUPAC Name:2,5-dinitro-1H-imidazole
Description:2,4-Dinitroimidazole (CAS# 5213-49-0) is a reagent that can be used to synthesize (S)-PA 824 (P122500), which is a novel anti-tuberculosis drug.
Molecular Weight:158.07
Molecular Formula:C3H2N4O4
Canonical SMILES:C1=C(NC(=N1)[N+](=O)[O-])[N+](=O)[O-]
InChI:InChI=1S/C3H2N4O4/c8-6(9)2-1-4-3(5-2)7(10)11/h1H,(H,4,5)
InChI Key:FLDSOXFRYVOGFK-UHFFFAOYSA-N
Boiling Point:503.1 ℃ at 760 mmHg
Density:1.867 g/cm3
MDL:MFCD00516999
LogP:1.27250

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Related Functional Groups

Imidazoles

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