potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate

CH8BrKNNaO9S — CID 160830960

IUPACpotassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate
SMILESNO.O.O=C(O)O.O=S(=O)([O-])O.[Br-].[K+].[Na+]
InChIInChI=1S/CH2O3.BrH.K.H3NO.Na.H2O4S.H2O/c2-1(3)4;;;1-2;;1-5(2,3)4;/h(H2,2,3,4);1H;;2H,1H2;;(H2,1,2,3,4);1H2/q;;+1;;+1;;/p-2
InChIKeySGUFXGFEXHMSDM-UHFFFAOYSA-L
MW352.13 g/mol
LogP-11.25
Rot. Bonds

About potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate

potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate (PubChem CID 160830960) has the molecular formula CH8BrKNNaO9S and a molecular weight of 352.13 g/mol. Its IUPAC name is potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate.

Molecular Properties

Compound Namepotassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate
PubChem CID160830960
Molecular FormulaCH8BrKNNaO9S
Molecular Weight352.13 g/mol
Exact Mass350.86
IUPAC Namepotassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate
SMILESNO.O.O=C(O)O.O=S(=O)([O-])O.[Br-].[K+].[Na+]
InChIInChI=1S/CH2O3.BrH.K.H3NO.Na.H2O4S.H2O/c2-1(3)4;;;1-2;;1-5(2,3)4;/h(H2,2,3,4);1H;;2H,1H2;;(H2,1,2,3,4);1H2/q;;+1;;+1;;/p-2
InChIKeySGUFXGFEXHMSDM-UHFFFAOYSA-L
XLogP-11.25
TPSA212.71 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.13
LogP ≤ 5-11.25
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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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strontium hydrogen sulfate
CID 160697720
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Frequently Asked Questions

What is the IUPAC name of potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate?
The IUPAC name of potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate (CID 160830960) is potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate.
What is the SMILES notation for potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate?
The canonical SMILES for potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate is NO.O.O=C(O)O.O=S(=O)([O-])O.[Br-].[K+].[Na+].
What is the InChIKey of potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate?
The InChIKey is SGUFXGFEXHMSDM-UHFFFAOYSA-L. The full InChI is InChI=1S/CH2O3.BrH.K.H3NO.Na.H2O4S.H2O/c2-1(3)4;;;1-2;;1-5(2,3)4;/h(H2,2,3,4);1H;;2H,1H2;;(H2,1,2,3,4);1H2/q;;+1;;+1;;/p-2.
What are the key properties of potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate?
potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate has a molecular weight of 352.13 g/mol, XLogP of -11.25, 0 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sodium;carbonic acid;hydrogen sulfate;hydroxylamine;bromide;hydrate is sourced from PubChem (CID 160830960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).