calcium;potassium;hydroxide;sulfate

HCaKO5S — CID 73415827

IUPACcalcium;potassium;hydroxide;sulfate
SMILESO=S(=O)([O-])[O-].[Ca+2].[K+].[OH-]
InChIInChI=1S/Ca.K.H2O4S.H2O/c;;1-5(2,3)4;/h;;(H2,1,2,3,4);1H2/q+2;+1;;/p-3
InChIKeySNBXCWVOMQIJEH-UHFFFAOYSA-K
MW192.25 g/mol
LogP-4.89
Rot. Bonds

About calcium;potassium;hydroxide;sulfate

calcium;potassium;hydroxide;sulfate (PubChem CID 73415827) has the molecular formula HCaKO5S and a molecular weight of 192.25 g/mol. Its IUPAC name is calcium;potassium;hydroxide;sulfate.

Molecular Properties

Compound Namecalcium;potassium;hydroxide;sulfate
PubChem CID73415827
Molecular FormulaHCaKO5S
Molecular Weight192.25 g/mol
Exact Mass191.88
IUPAC Namecalcium;potassium;hydroxide;sulfate
SMILESO=S(=O)([O-])[O-].[Ca+2].[K+].[OH-]
InChIInChI=1S/Ca.K.H2O4S.H2O/c;;1-5(2,3)4;/h;;(H2,1,2,3,4);1H2/q+2;+1;;/p-3
InChIKeySNBXCWVOMQIJEH-UHFFFAOYSA-K
XLogP-4.89
TPSA110.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 5-4.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

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dicalcium;hydroxide;sulfate;hydrate
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dicalcium;sulfate
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molybdenum trisulfate
CID 23513550
aluminum;calcium;sodium;dihydroxide;sulfate
CID 172701795
calcium;copper;sulfate
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CID 140700884
beryllium;potassium;sulfate
CID 20841736
tripotassium;titanium(2+);sulfate
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nickel(2+);chloride;sulfate
CID 19745759

Frequently Asked Questions

What is the IUPAC name of calcium;potassium;hydroxide;sulfate?
The IUPAC name of calcium;potassium;hydroxide;sulfate (CID 73415827) is calcium;potassium;hydroxide;sulfate.
What is the SMILES notation for calcium;potassium;hydroxide;sulfate?
The canonical SMILES for calcium;potassium;hydroxide;sulfate is O=S(=O)([O-])[O-].[Ca+2].[K+].[OH-].
What is the InChIKey of calcium;potassium;hydroxide;sulfate?
The InChIKey is SNBXCWVOMQIJEH-UHFFFAOYSA-K. The full InChI is InChI=1S/Ca.K.H2O4S.H2O/c;;1-5(2,3)4;/h;;(H2,1,2,3,4);1H2/q+2;+1;;/p-3.
What are the key properties of calcium;potassium;hydroxide;sulfate?
calcium;potassium;hydroxide;sulfate has a molecular weight of 192.25 g/mol, XLogP of -4.89, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;potassium;hydroxide;sulfate is sourced from PubChem (CID 73415827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).