calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate

H2CaKNaO7Si2 — CID 173024308

IUPACcalcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate
SMILESO.O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Ca+2].[K+].[Na+]
InChIInChI=1S/Ca.K.Na.2O3Si.H2O/c;;;2*1-4(2)3;/h;;;;;1H2/q+2;2*+1;2*-2;
InChIKeyIMOFEZGHBOQHFW-UHFFFAOYSA-N
MW272.35 g/mol
LogP-12.95
Rot. Bonds

About calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate

calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate (PubChem CID 173024308) has the molecular formula H2CaKNaO7Si2 and a molecular weight of 272.35 g/mol. Its IUPAC name is calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate.

Molecular Properties

Compound Namecalcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate
PubChem CID173024308
Molecular FormulaH2CaKNaO7Si2
Molecular Weight272.35 g/mol
Exact Mass271.85
IUPAC Namecalcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate
SMILESO.O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Ca+2].[K+].[Na+]
InChIInChI=1S/Ca.K.Na.2O3Si.H2O/c;;;2*1-4(2)3;/h;;;;;1H2/q+2;2*+1;2*-2;
InChIKeyIMOFEZGHBOQHFW-UHFFFAOYSA-N
XLogP-12.95
TPSA157.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 5-12.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate?
The IUPAC name of calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate (CID 173024308) is calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate.
What is the SMILES notation for calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate?
The canonical SMILES for calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate is O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Ca+2].[K+].[Na+].
What is the InChIKey of calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate?
The InChIKey is IMOFEZGHBOQHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.K.Na.2O3Si.H2O/c;;;2*1-4(2)3;/h;;;;;1H2/q+2;2*+1;2*-2;.
What are the key properties of calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate?
calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate has a molecular weight of 272.35 g/mol, XLogP of -12.95, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;potassium;sodium;bis(dioxido(oxo)silane);hydrate is sourced from PubChem (CID 173024308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).