arsoric acid;zirconium;hydrate

H5AsO5Zr — CID 173447278

IUPACarsoric acid;zirconium;hydrate
SMILESO.O=[As](O)(O)O.[Zr]
InChIInChI=1S/AsH3O4.H2O.Zr/c2-1(3,4)5;;/h(H3,2,3,4,5);1H2;
InChIKeyRTWFKRKNRGVQFN-UHFFFAOYSA-N
MW251.18 g/mol
LogP-3.00
Rot. Bonds

About arsoric acid;zirconium;hydrate

arsoric acid;zirconium;hydrate (PubChem CID 173447278) has the molecular formula H5AsO5Zr and a molecular weight of 251.18 g/mol. Its IUPAC name is arsoric acid;zirconium;hydrate.

Molecular Properties

Compound Namearsoric acid;zirconium;hydrate
PubChem CID173447278
Molecular FormulaH5AsO5Zr
Molecular Weight251.18 g/mol
Exact Mass249.84
IUPAC Namearsoric acid;zirconium;hydrate
SMILESO.O=[As](O)(O)O.[Zr]
InChIInChI=1S/AsH3O4.H2O.Zr/c2-1(3,4)5;;/h(H3,2,3,4,5);1H2;
InChIKeyRTWFKRKNRGVQFN-UHFFFAOYSA-N
XLogP-3.00
TPSA109.26 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.18
LogP ≤ 5-3.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 23725018
CID 23725018
arsoric acid;selane
CID 172725516
arsoric acid;yttrium
CID 173376520
arsoric acid;λ2-plumbane
CID 172995596
arsoric acid;copper
CID 57449169
arsoric acid;copper;zinc
CID 57450418
Arsenic acid (H3AsO4), ammonium magnesium salt (1:1:1)
CID 131873917
hexalithium;arsoric acid;hexafluoride
CID 22020558
calcium;sodium;arsoric acid;hydride
CID 173397963
tris(zirconium(4+));tetraarsorate;hydrate
CID 173447280
dimethylarsinic acid
CID 87073608
hydrogen arsorate
CID 233

Frequently Asked Questions

What is the IUPAC name of arsoric acid;zirconium;hydrate?
The IUPAC name of arsoric acid;zirconium;hydrate (CID 173447278) is arsoric acid;zirconium;hydrate.
What is the SMILES notation for arsoric acid;zirconium;hydrate?
The canonical SMILES for arsoric acid;zirconium;hydrate is O.O=[As](O)(O)O.[Zr].
What is the InChIKey of arsoric acid;zirconium;hydrate?
The InChIKey is RTWFKRKNRGVQFN-UHFFFAOYSA-N. The full InChI is InChI=1S/AsH3O4.H2O.Zr/c2-1(3,4)5;;/h(H3,2,3,4,5);1H2;.
What are the key properties of arsoric acid;zirconium;hydrate?
arsoric acid;zirconium;hydrate has a molecular weight of 251.18 g/mol, XLogP of -3.00, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for arsoric acid;zirconium;hydrate is sourced from PubChem (CID 173447278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).