potassium;azane;hydrogen sulfate;nitric acid

H5KN2O7S — CID 174793331

IUPACpotassium;azane;hydrogen sulfate;nitric acid
SMILESN.O=S(=O)([O-])O.O=[N+]([O-])O.[K+]
InChIInChI=1S/K.HNO3.H3N.H2O4S/c;2-1(3)4;;1-5(2,3)4/h;(H,2,3,4);1H3;(H2,1,2,3,4)/q+1;;;/p-1
InChIKeyIUIJORSTDKTEOB-UHFFFAOYSA-M
MW216.21 g/mol
LogP-4.18
Rot. Bonds

About potassium;azane;hydrogen sulfate;nitric acid

potassium;azane;hydrogen sulfate;nitric acid (PubChem CID 174793331) has the molecular formula H5KN2O7S and a molecular weight of 216.21 g/mol. Its IUPAC name is potassium;azane;hydrogen sulfate;nitric acid.

Molecular Properties

Compound Namepotassium;azane;hydrogen sulfate;nitric acid
PubChem CID174793331
Molecular FormulaH5KN2O7S
Molecular Weight216.21 g/mol
Exact Mass215.95
IUPAC Namepotassium;azane;hydrogen sulfate;nitric acid
SMILESN.O=S(=O)([O-])O.O=[N+]([O-])O.[K+]
InChIInChI=1S/K.HNO3.H3N.H2O4S/c;2-1(3)4;;1-5(2,3)4/h;(H,2,3,4);1H3;(H2,1,2,3,4)/q+1;;;/p-1
InChIKeyIUIJORSTDKTEOB-UHFFFAOYSA-M
XLogP-4.18
TPSA175.80 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.21
LogP ≤ 5-4.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;azane;hydrogen sulfate;nitric acid?
The IUPAC name of potassium;azane;hydrogen sulfate;nitric acid (CID 174793331) is potassium;azane;hydrogen sulfate;nitric acid.
What is the SMILES notation for potassium;azane;hydrogen sulfate;nitric acid?
The canonical SMILES for potassium;azane;hydrogen sulfate;nitric acid is N.O=S(=O)([O-])O.O=[N+]([O-])O.[K+].
What is the InChIKey of potassium;azane;hydrogen sulfate;nitric acid?
The InChIKey is IUIJORSTDKTEOB-UHFFFAOYSA-M. The full InChI is InChI=1S/K.HNO3.H3N.H2O4S/c;2-1(3)4;;1-5(2,3)4/h;(H,2,3,4);1H3;(H2,1,2,3,4)/q+1;;;/p-1.
What are the key properties of potassium;azane;hydrogen sulfate;nitric acid?
potassium;azane;hydrogen sulfate;nitric acid has a molecular weight of 216.21 g/mol, XLogP of -4.18, 0 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;azane;hydrogen sulfate;nitric acid is sourced from PubChem (CID 174793331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).