oxozirconium(2+);dichloride;heptahydrate

H14Cl2O8Zr — CID 19374099

IUPACoxozirconium(2+);dichloride;heptahydrate
SMILESO.O.O.O.O.O.O.O=[Zr+2].[Cl-].[Cl-]
InChIInChI=1S/2ClH.7H2O.O.Zr/h2*1H;7*1H2;;/q;;;;;;;;;;+2/p-2
InChIKeyIILOKEJNFJEDMR-UHFFFAOYSA-L
MW304.23 g/mol
LogP-11.89
Rot. Bonds

About oxozirconium(2+);dichloride;heptahydrate

oxozirconium(2+);dichloride;heptahydrate (PubChem CID 19374099) has the molecular formula H14Cl2O8Zr and a molecular weight of 304.23 g/mol. Its IUPAC name is oxozirconium(2+);dichloride;heptahydrate.

Molecular Properties

Compound Nameoxozirconium(2+);dichloride;heptahydrate
PubChem CID19374099
Molecular FormulaH14Cl2O8Zr
Molecular Weight304.23 g/mol
Exact Mass301.91
IUPAC Nameoxozirconium(2+);dichloride;heptahydrate
SMILESO.O.O.O.O.O.O.O=[Zr+2].[Cl-].[Cl-]
InChIInChI=1S/2ClH.7H2O.O.Zr/h2*1H;7*1H2;;/q;;;;;;;;;;+2/p-2
InChIKeyIILOKEJNFJEDMR-UHFFFAOYSA-L
XLogP-11.89
TPSA237.57 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.23
LogP ≤ 5-11.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

oxozirconium(2+);dihydroxide;hydrate
CID 23047042
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CID 57372133
argon;carbon dioxide;hydrate
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molybdenum(3+);pentachloride;hydrate
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copper;chloride;tetrahydrate
CID 21217264
potassium;argon;chloride
CID 161392826
yttrium;zirconium;trihydrate
CID 173045464
carbanide;bis(yttrium);dihydrate
CID 58012843
iron(2+);chloride;hydrate
CID 22731553
molecular oxygen;tetrahydrate
CID 162300735

Frequently Asked Questions

What is the IUPAC name of oxozirconium(2+);dichloride;heptahydrate?
The IUPAC name of oxozirconium(2+);dichloride;heptahydrate (CID 19374099) is oxozirconium(2+);dichloride;heptahydrate.
What is the SMILES notation for oxozirconium(2+);dichloride;heptahydrate?
The canonical SMILES for oxozirconium(2+);dichloride;heptahydrate is O.O.O.O.O.O.O.O=[Zr+2].[Cl-].[Cl-].
What is the InChIKey of oxozirconium(2+);dichloride;heptahydrate?
The InChIKey is IILOKEJNFJEDMR-UHFFFAOYSA-L. The full InChI is InChI=1S/2ClH.7H2O.O.Zr/h2*1H;7*1H2;;/q;;;;;;;;;;+2/p-2.
What are the key properties of oxozirconium(2+);dichloride;heptahydrate?
oxozirconium(2+);dichloride;heptahydrate has a molecular weight of 304.23 g/mol, XLogP of -11.89, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for oxozirconium(2+);dichloride;heptahydrate is sourced from PubChem (CID 19374099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).