azanium;nitric acid;nitrite

H5N3O5 — CID 22114427

IUPACazanium;nitric acid;nitrite
SMILESO=N[O-].O=[N+]([O-])O.[NH4+]
InChIInChI=1S/HNO3.HNO2.H3N/c2-1(3)4;2-1-3;/h(H,2,3,4);(H,2,3);1H3
InChIKeyAUJWFEDOKMPQCR-UHFFFAOYSA-N
MW127.06 g/mol
LogP0.28
Rot. Bonds

About azanium;nitric acid;nitrite

azanium;nitric acid;nitrite (PubChem CID 22114427) has the molecular formula H5N3O5 and a molecular weight of 127.06 g/mol. Its IUPAC name is azanium;nitric acid;nitrite.

Molecular Properties

Compound Nameazanium;nitric acid;nitrite
PubChem CID22114427
Molecular FormulaH5N3O5
Molecular Weight127.06 g/mol
Exact Mass127.02
IUPAC Nameazanium;nitric acid;nitrite
SMILESO=N[O-].O=[N+]([O-])O.[NH4+]
InChIInChI=1S/HNO3.HNO2.H3N/c2-1(3)4;2-1-3;/h(H,2,3,4);(H,2,3);1H3
InChIKeyAUJWFEDOKMPQCR-UHFFFAOYSA-N
XLogP0.28
TPSA152.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.06
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 22990458
sodium;nitric acid;phosphoric acid;nitrite
CID 172779040
nitrate nitrite
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ruthenium(2+);nitrate;nitrite
CID 175288692
cobalt;bis(nitric acid)
CID 59294240
lutetium;nitric acid
CID 54604402
hydrogen peroxide;nitric acid
CID 22590704
azane;tetrakis(nitric acid)
CID 173388272
azane;(nitric acid)
CID 173431766
CID 173018650
CID 173018650
einsteinium;tris(nitric acid)
CID 131879224

Frequently Asked Questions

What is the IUPAC name of azanium;nitric acid;nitrite?
The IUPAC name of azanium;nitric acid;nitrite (CID 22114427) is azanium;nitric acid;nitrite.
What is the SMILES notation for azanium;nitric acid;nitrite?
The canonical SMILES for azanium;nitric acid;nitrite is O=N[O-].O=[N+]([O-])O.[NH4+].
What is the InChIKey of azanium;nitric acid;nitrite?
The InChIKey is AUJWFEDOKMPQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/HNO3.HNO2.H3N/c2-1(3)4;2-1-3;/h(H,2,3,4);(H,2,3);1H3.
What are the key properties of azanium;nitric acid;nitrite?
azanium;nitric acid;nitrite has a molecular weight of 127.06 g/mol, XLogP of 0.28, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;nitric acid;nitrite is sourced from PubChem (CID 22114427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).