alumane;zirconium;hydrate;tetrahydrochloride

H9AlCl4OZr — CID 173043216

IUPACalumane;zirconium;hydrate;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.O.[AlH3].[Zr]
InChIInChI=1S/Al.4ClH.H2O.Zr.3H/h;4*1H;1H2;;;;
InChIKeyXAWQSCRURNSCGW-UHFFFAOYSA-N
MW285.09 g/mol
LogP-0.32
Rot. Bonds

About alumane;zirconium;hydrate;tetrahydrochloride

alumane;zirconium;hydrate;tetrahydrochloride (PubChem CID 173043216) has the molecular formula H9AlCl4OZr and a molecular weight of 285.09 g/mol. Its IUPAC name is alumane;zirconium;hydrate;tetrahydrochloride.

Molecular Properties

Compound Namealumane;zirconium;hydrate;tetrahydrochloride
PubChem CID173043216
Molecular FormulaH9AlCl4OZr
Molecular Weight285.09 g/mol
Exact Mass281.83
IUPAC Namealumane;zirconium;hydrate;tetrahydrochloride
SMILESCl.Cl.Cl.Cl.O.[AlH3].[Zr]
InChIInChI=1S/Al.4ClH.H2O.Zr.3H/h;4*1H;1H2;;;;
InChIKeyXAWQSCRURNSCGW-UHFFFAOYSA-N
XLogP-0.32
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.09
LogP ≤ 5-0.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of alumane;zirconium;hydrate;tetrahydrochloride?
The IUPAC name of alumane;zirconium;hydrate;tetrahydrochloride (CID 173043216) is alumane;zirconium;hydrate;tetrahydrochloride.
What is the SMILES notation for alumane;zirconium;hydrate;tetrahydrochloride?
The canonical SMILES for alumane;zirconium;hydrate;tetrahydrochloride is Cl.Cl.Cl.Cl.O.[AlH3].[Zr].
What is the InChIKey of alumane;zirconium;hydrate;tetrahydrochloride?
The InChIKey is XAWQSCRURNSCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.4ClH.H2O.Zr.3H/h;4*1H;1H2;;;;.
What are the key properties of alumane;zirconium;hydrate;tetrahydrochloride?
alumane;zirconium;hydrate;tetrahydrochloride has a molecular weight of 285.09 g/mol, XLogP of -0.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;zirconium;hydrate;tetrahydrochloride is sourced from PubChem (CID 173043216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).