nitric acid;oxido-oxo-sulfooxyphosphanium

H2NO9PS — CID 174853073

IUPACnitric acid;oxido-oxo-sulfooxyphosphanium
SMILESO=[N+]([O-])O.O=[P+]([O-])OS(=O)(=O)O
InChIInChI=1S/HNO3.HO6PS/c2-1(3)4;1-7(2)6-8(3,4)5/h(H,2,3,4);(H,3,4,5)
InChIKeyHXVUVGGYAJMPSL-UHFFFAOYSA-N
MW223.05 g/mol
LogP-1.52
Rot. Bonds2

About nitric acid;oxido-oxo-sulfooxyphosphanium

nitric acid;oxido-oxo-sulfooxyphosphanium (PubChem CID 174853073) has the molecular formula H2NO9PS and a molecular weight of 223.05 g/mol. Its IUPAC name is nitric acid;oxido-oxo-sulfooxyphosphanium.

Molecular Properties

Compound Namenitric acid;oxido-oxo-sulfooxyphosphanium
PubChem CID174853073
Molecular FormulaH2NO9PS
Molecular Weight223.05 g/mol
Exact Mass222.92
IUPAC Namenitric acid;oxido-oxo-sulfooxyphosphanium
SMILESO=[N+]([O-])O.O=[P+]([O-])OS(=O)(=O)O
InChIInChI=1S/HNO3.HO6PS/c2-1(3)4;1-7(2)6-8(3,4)5/h(H,2,3,4);(H,3,4,5)
InChIKeyHXVUVGGYAJMPSL-UHFFFAOYSA-N
XLogP-1.52
TPSA167.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.05
LogP ≤ 5-1.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze nitric acid;oxido-oxo-sulfooxyphosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

oxido-oxo-sulfooxysulfonyloxyphosphanium
CID 154300996
dicalcium;hydride;nitric acid;sulfuric acid
CID 173395522
nitric acid;sulfurochloridic acid
CID 23373927
sodium;hydride;nitric acid;sulfuric acid
CID 174264171
nitric acid;ruthenium;dinitrate
CID 173436166
potassium;azane;hydrogen sulfate;nitric acid
CID 174793331
nitro hydrogen sulfate;silver
CID 174582491
methanesulfonic acid;nitric acid;sulfuric acid;hydrobromide;hydrochloride
CID 159704639
azane;cerium;cobalt;nitric acid;sulfamic acid
CID 174884771
bis(nitric acid);platinum
CID 50910635
cobalt;bis(nitric acid)
CID 59294240
cadmium;bis(nitric acid)
CID 72833329

Frequently Asked Questions

What is the IUPAC name of nitric acid;oxido-oxo-sulfooxyphosphanium?
The IUPAC name of nitric acid;oxido-oxo-sulfooxyphosphanium (CID 174853073) is nitric acid;oxido-oxo-sulfooxyphosphanium.
What is the SMILES notation for nitric acid;oxido-oxo-sulfooxyphosphanium?
The canonical SMILES for nitric acid;oxido-oxo-sulfooxyphosphanium is O=[N+]([O-])O.O=[P+]([O-])OS(=O)(=O)O.
What is the InChIKey of nitric acid;oxido-oxo-sulfooxyphosphanium?
The InChIKey is HXVUVGGYAJMPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/HNO3.HO6PS/c2-1(3)4;1-7(2)6-8(3,4)5/h(H,2,3,4);(H,3,4,5).
What are the key properties of nitric acid;oxido-oxo-sulfooxyphosphanium?
nitric acid;oxido-oxo-sulfooxyphosphanium has a molecular weight of 223.05 g/mol, XLogP of -1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for nitric acid;oxido-oxo-sulfooxyphosphanium is sourced from PubChem (CID 174853073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).