3,5-Dinitroquinoline 1-oxide structure

3,5-Dinitroquinoline 1-oxide

3,5-dinitro-1-oxidoquinolin-1-ium

Also Known As: 3,5-Dinitroquinoline 1-oxide|Quinoline, 3,5-dinitro-, 1-oxide|3,5-dinitro-1-oxidoquinolin-1-ium|3,5-Dinitro-1-oxo-1lambda~5~-quinoline

CAS: 6345-98-8
Molecular Formula C9H5N3O5
Molecular Weight 235.02292 g/mol
LogP 0.3
Topological Polar Surface Area 117.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 0
Exact Mass 235.02292
Monoisotopic Mass 235.02292
Heavy Atoms 17
Complexity 326.0

Chemical Identifiers

CAS Number 6345-98-8
SMILES C1=CC2=C(C=C(C=[N+]2[O-])[N+](=O)[O-])C(=C1)[N+](=O)[O-]
InChIKey NEVAXGHVBXBVFX-UHFFFAOYSA-N

Product Overview

3,5-Dinitroquinoline 1-oxide (CAS 6345-98-8), with molecular formula C9H5N3O5 and molecular weight 235.02292 g/mol. IUPAC: 3,5-dinitro-1-oxidoquinolin-1-ium.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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