strontium;barium(2+);hydride;phthalic acid;zirconium

C8H10BaO4SrZr — CID 174634616

IUPACstrontium;barium(2+);hydride;phthalic acid;zirconium
SMILESO=C(O)c1ccccc1C(=O)O.[Ba+2].[H-].[H-].[H-].[H-].[Sr+2].[Zr]
InChIInChI=1S/C8H6O4.Ba.Sr.Zr.4H/c9-7(10)5-3-1-2-4-6(5)8(11)12;;;;;;;/h1-4H,(H,9,10)(H,11,12);;;;;;;/q;2*+2;;4*-1
InChIKeyZEKKCIOLSWZASY-UHFFFAOYSA-N
MW486.34 g/mol
LogP0.77
Rot. Bonds2

About strontium;barium(2+);hydride;phthalic acid;zirconium

strontium;barium(2+);hydride;phthalic acid;zirconium (PubChem CID 174634616) has the molecular formula C8H10BaO4SrZr and a molecular weight of 486.34 g/mol. Its IUPAC name is strontium;barium(2+);hydride;phthalic acid;zirconium.

Molecular Properties

Compound Namestrontium;barium(2+);hydride;phthalic acid;zirconium
PubChem CID174634616
Molecular FormulaC8H10BaO4SrZr
Molecular Weight486.34 g/mol
Exact Mass485.77
IUPAC Namestrontium;barium(2+);hydride;phthalic acid;zirconium
SMILESO=C(O)c1ccccc1C(=O)O.[Ba+2].[H-].[H-].[H-].[H-].[Sr+2].[Zr]
InChIInChI=1S/C8H6O4.Ba.Sr.Zr.4H/c9-7(10)5-3-1-2-4-6(5)8(11)12;;;;;;;/h1-4H,(H,9,10)(H,11,12);;;;;;;/q;2*+2;;4*-1
InChIKeyZEKKCIOLSWZASY-UHFFFAOYSA-N
XLogP0.77
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.34
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of strontium;barium(2+);hydride;phthalic acid;zirconium?
The IUPAC name of strontium;barium(2+);hydride;phthalic acid;zirconium (CID 174634616) is strontium;barium(2+);hydride;phthalic acid;zirconium.
What is the SMILES notation for strontium;barium(2+);hydride;phthalic acid;zirconium?
The canonical SMILES for strontium;barium(2+);hydride;phthalic acid;zirconium is O=C(O)c1ccccc1C(=O)O.[Ba+2].[H-].[H-].[H-].[H-].[Sr+2].[Zr].
What is the InChIKey of strontium;barium(2+);hydride;phthalic acid;zirconium?
The InChIKey is ZEKKCIOLSWZASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4.Ba.Sr.Zr.4H/c9-7(10)5-3-1-2-4-6(5)8(11)12;;;;;;;/h1-4H,(H,9,10)(H,11,12);;;;;;;/q;2*+2;;4*-1.
What are the key properties of strontium;barium(2+);hydride;phthalic acid;zirconium?
strontium;barium(2+);hydride;phthalic acid;zirconium has a molecular weight of 486.34 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for strontium;barium(2+);hydride;phthalic acid;zirconium is sourced from PubChem (CID 174634616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).