calcium;strontium;barium(2+);hydride;hydrate

H8BaCaOSr — CID 173196664

IUPACcalcium;strontium;barium(2+);hydride;hydrate
SMILESO.[Ba+2].[Ca+2].[H-].[H-].[H-].[H-].[H-].[H-].[Sr+2]
InChIInChI=1S/Ba.Ca.H2O.Sr.6H/h;;1H2;;;;;;;/q2*+2;;+2;6*-1
InChIKeyKCTGXOJPBIIGCK-UHFFFAOYSA-N
MW289.09 g/mol
LogP-1.29
Rot. Bonds

About calcium;strontium;barium(2+);hydride;hydrate

calcium;strontium;barium(2+);hydride;hydrate (PubChem CID 173196664) has the molecular formula H8BaCaOSr and a molecular weight of 289.09 g/mol. Its IUPAC name is calcium;strontium;barium(2+);hydride;hydrate.

Molecular Properties

Compound Namecalcium;strontium;barium(2+);hydride;hydrate
PubChem CID173196664
Molecular FormulaH8BaCaOSr
Molecular Weight289.09 g/mol
Exact Mass289.83
IUPAC Namecalcium;strontium;barium(2+);hydride;hydrate
SMILESO.[Ba+2].[Ca+2].[H-].[H-].[H-].[H-].[H-].[H-].[Sr+2]
InChIInChI=1S/Ba.Ca.H2O.Sr.6H/h;;1H2;;;;;;;/q2*+2;;+2;6*-1
InChIKeyKCTGXOJPBIIGCK-UHFFFAOYSA-N
XLogP-1.29
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.09
LogP ≤ 5-1.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of calcium;strontium;barium(2+);hydride;hydrate?
The IUPAC name of calcium;strontium;barium(2+);hydride;hydrate (CID 173196664) is calcium;strontium;barium(2+);hydride;hydrate.
What is the SMILES notation for calcium;strontium;barium(2+);hydride;hydrate?
The canonical SMILES for calcium;strontium;barium(2+);hydride;hydrate is O.[Ba+2].[Ca+2].[H-].[H-].[H-].[H-].[H-].[H-].[Sr+2].
What is the InChIKey of calcium;strontium;barium(2+);hydride;hydrate?
The InChIKey is KCTGXOJPBIIGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/Ba.Ca.H2O.Sr.6H/h;;1H2;;;;;;;/q2*+2;;+2;6*-1.
What are the key properties of calcium;strontium;barium(2+);hydride;hydrate?
calcium;strontium;barium(2+);hydride;hydrate has a molecular weight of 289.09 g/mol, XLogP of -1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;strontium;barium(2+);hydride;hydrate is sourced from PubChem (CID 173196664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).