sodium;hydrogen sulfate;nitrous acid

H2NNaO6S — CID 173241300

IUPACsodium;hydrogen sulfate;nitrous acid
SMILESO=NO.O=S(=O)([O-])O.[Na+]
InChIInChI=1S/HNO2.Na.H2O4S/c2-1-3;;1-5(2,3)4/h(H,2,3);;(H2,1,2,3,4)/q;+1;/p-1
InChIKeyQDPQGFCZJZJQQC-UHFFFAOYSA-M
MW167.07 g/mol
LogP-3.85
Rot. Bonds

About sodium;hydrogen sulfate;nitrous acid

sodium;hydrogen sulfate;nitrous acid (PubChem CID 173241300) has the molecular formula H2NNaO6S and a molecular weight of 167.07 g/mol. Its IUPAC name is sodium;hydrogen sulfate;nitrous acid.

Molecular Properties

Compound Namesodium;hydrogen sulfate;nitrous acid
PubChem CID173241300
Molecular FormulaH2NNaO6S
Molecular Weight167.07 g/mol
Exact Mass166.95
IUPAC Namesodium;hydrogen sulfate;nitrous acid
SMILESO=NO.O=S(=O)([O-])O.[Na+]
InChIInChI=1S/HNO2.Na.H2O4S/c2-1-3;;1-5(2,3)4/h(H,2,3);;(H2,1,2,3,4)/q;+1;/p-1
InChIKeyQDPQGFCZJZJQQC-UHFFFAOYSA-M
XLogP-3.85
TPSA127.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.07
LogP ≤ 5-3.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

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azane;nitrous acid;platinum(4+);dichloride;sulfate
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hydrogen sulfate;zirconium(4+)
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sodium;hydrogen sulfate;phosphorous acid
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hydrogen sulfate;hydron;silver
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Frequently Asked Questions

What is the IUPAC name of sodium;hydrogen sulfate;nitrous acid?
The IUPAC name of sodium;hydrogen sulfate;nitrous acid (CID 173241300) is sodium;hydrogen sulfate;nitrous acid.
What is the SMILES notation for sodium;hydrogen sulfate;nitrous acid?
The canonical SMILES for sodium;hydrogen sulfate;nitrous acid is O=NO.O=S(=O)([O-])O.[Na+].
What is the InChIKey of sodium;hydrogen sulfate;nitrous acid?
The InChIKey is QDPQGFCZJZJQQC-UHFFFAOYSA-M. The full InChI is InChI=1S/HNO2.Na.H2O4S/c2-1-3;;1-5(2,3)4/h(H,2,3);;(H2,1,2,3,4)/q;+1;/p-1.
What are the key properties of sodium;hydrogen sulfate;nitrous acid?
sodium;hydrogen sulfate;nitrous acid has a molecular weight of 167.07 g/mol, XLogP of -3.85, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydrogen sulfate;nitrous acid is sourced from PubChem (CID 173241300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).