Pyridazine, 4,6-dinitro-3-methoxy-, 1-oxide

HCID 215315

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 35436-15-8
Standard SMILES: COc1n[n+]([O-])c([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey: GCBFEKOPFMITSV-UHFFFAOYSA-N
Molecular formula: C5H4N4O6
Average molar mass: 216.11 g/mol
Monoisotopic mass: 216.01308386

Names & identifiers

Preferred name: Pyridazine, 4,6-dinitro-3-methoxy-, 1-oxide
IUPAC: 3-methoxy-4,6-dinitro-1-oxidopyridazin-1-ium

Names & synonyms

Pyridazine, 4,6-dinitro-3-methoxy-, 1-oxide35436-15-8BRN 08903564,6-Dinitro-3-methoxypyridazine 1-oxideDTXSID40188917RefChem:376360DTXCID001114083-methoxy-4,6-dinitropyridazine 1-oxide3-methoxy-4,6-dinitro-1-oxidopyridazin-1-iumAP-782/418854443-Methoxy-4,6-dinitro-1-oxo-1lambda~5~-pyridazine

Database identifiers

CAS: 35436-15-8
PubChem CID: 215315
DTXSID: DTXSID40188917

Properties

Computed structural properties

XLogP: -0.3
Topological polar surface area: 139 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 261

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…