sodium;sulfuric acid;nitrate

H2NNaO7S — CID 131742416

IUPACsodium;sulfuric acid;nitrate
SMILESO=S(=O)(O)O.O=[N+]([O-])[O-].[Na+]
InChIInChI=1S/NO3.Na.H2O4S/c2-1(3)4;;1-5(2,3)4/h;;(H2,1,2,3,4)/q-1;+1;
InChIKeyRLFBMFBORXBCQC-UHFFFAOYSA-N
MW183.07 g/mol
LogP-3.89
Rot. Bonds

About sodium;sulfuric acid;nitrate

sodium;sulfuric acid;nitrate (PubChem CID 131742416) has the molecular formula H2NNaO7S and a molecular weight of 183.07 g/mol. Its IUPAC name is sodium;sulfuric acid;nitrate.

Molecular Properties

Compound Namesodium;sulfuric acid;nitrate
PubChem CID131742416
Molecular FormulaH2NNaO7S
Molecular Weight183.07 g/mol
Exact Mass182.94
IUPAC Namesodium;sulfuric acid;nitrate
SMILESO=S(=O)(O)O.O=[N+]([O-])[O-].[Na+]
InChIInChI=1S/NO3.Na.H2O4S/c2-1(3)4;;1-5(2,3)4/h;;(H2,1,2,3,4)/q-1;+1;
InChIKeyRLFBMFBORXBCQC-UHFFFAOYSA-N
XLogP-3.89
TPSA140.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.07
LogP ≤ 5-3.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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'}

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Related Compounds

potassium;sulfuric acid;nitrate
CID 23434685
aluminum;λ2-stannane;sulfuric acid;nitrate
CID 173129779
alumane;λ2-stannane;sulfuric acid;nitrate
CID 173129778
sodium;hydride;nitric acid;sulfuric acid
CID 174264171
calcium;dipotassium;disodium;azane;sulfuric acid;trichloride;nitrate;sulfate;hydrochloride
CID 174953279
dicalcium;hydride;nitric acid;sulfuric acid
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osmium(4+) dinitrate
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bis(osmium(4+));octanitrate
CID 158143113
tetrasilver;tetranitrate
CID 172745321
tetrasodium;sulfuric acid;disulfate
CID 172828652
sodium;sulfuric acid;sulfate
CID 19758473
sodium;azane;nitric acid;nitrous acid;sulfuric acid;chloride
CID 159120383

Frequently Asked Questions

What is the IUPAC name of sodium;sulfuric acid;nitrate?
The IUPAC name of sodium;sulfuric acid;nitrate (CID 131742416) is sodium;sulfuric acid;nitrate.
What is the SMILES notation for sodium;sulfuric acid;nitrate?
The canonical SMILES for sodium;sulfuric acid;nitrate is O=S(=O)(O)O.O=[N+]([O-])[O-].[Na+].
What is the InChIKey of sodium;sulfuric acid;nitrate?
The InChIKey is RLFBMFBORXBCQC-UHFFFAOYSA-N. The full InChI is InChI=1S/NO3.Na.H2O4S/c2-1(3)4;;1-5(2,3)4/h;;(H2,1,2,3,4)/q-1;+1;.
What are the key properties of sodium;sulfuric acid;nitrate?
sodium;sulfuric acid;nitrate has a molecular weight of 183.07 g/mol, XLogP of -3.89, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;sulfuric acid;nitrate is sourced from PubChem (CID 131742416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).