barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate

H2BaO8PbSSi — CID 173462631

IUPACbarium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate
SMILESO=S(=O)([O-])[O-].[Ba+2].[O-][Si]([O-])(O)O.[Pb+2]
InChIInChI=1S/Ba.H2O4S.H2O4Si.Pb/c;2*1-5(2,3)4;/h;(H2,1,2,3,4);1-2H;/q+2;;-2;+2/p-2
InChIKeyWRHLHZGZGSFQBA-UHFFFAOYSA-L
MW534.69 g/mol
LogP-5.97
Rot. Bonds

About barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate

barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate (PubChem CID 173462631) has the molecular formula H2BaO8PbSSi and a molecular weight of 534.69 g/mol. Its IUPAC name is barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate.

Molecular Properties

Compound Namebarium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate
PubChem CID173462631
Molecular FormulaH2BaO8PbSSi
Molecular Weight534.69 g/mol
Exact Mass535.81
IUPAC Namebarium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate
SMILESO=S(=O)([O-])[O-].[Ba+2].[O-][Si]([O-])(O)O.[Pb+2]
InChIInChI=1S/Ba.H2O4S.H2O4Si.Pb/c;2*1-5(2,3)4;/h;(H2,1,2,3,4);1-2H;/q+2;;-2;+2/p-2
InChIKeyWRHLHZGZGSFQBA-UHFFFAOYSA-L
XLogP-5.97
TPSA166.84 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500534.69
LogP ≤ 5-5.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

magnesium;dihydroxy(dioxido)silane;sulfuric acid
CID 173040937
lithium;dihydroxy(dioxido)silane;oxostibanylium
CID 173299735
tris(barium(2+));sulfuric acid;trisulfate
CID 173274297
barium(2+);thorium(4+);trisulfate
CID 158644230
potassium;silver;dihydroxy(dioxido)silane
CID 174425604
lead(2+);stibane;sulfate
CID 175316158
magnesium;lead(2+);disulfate
CID 159783766
strontium;barium(2+);disulfate
CID 54725521
azanide;bis(lead(2+));sulfate
CID 172999396
hexadecasilver;octasulfate
CID 174664647
boric acid;lead(2+);sulfate
CID 175363823
zinc;barium(2+);hydride;sulfate
CID 173310987

Frequently Asked Questions

What is the IUPAC name of barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate?
The IUPAC name of barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate (CID 173462631) is barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate.
What is the SMILES notation for barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate?
The canonical SMILES for barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate is O=S(=O)([O-])[O-].[Ba+2].[O-][Si]([O-])(O)O.[Pb+2].
What is the InChIKey of barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate?
The InChIKey is WRHLHZGZGSFQBA-UHFFFAOYSA-L. The full InChI is InChI=1S/Ba.H2O4S.H2O4Si.Pb/c;2*1-5(2,3)4;/h;(H2,1,2,3,4);1-2H;/q+2;;-2;+2/p-2.
What are the key properties of barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate?
barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate has a molecular weight of 534.69 g/mol, XLogP of -5.97, 0 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);dihydroxy(dioxido)silane;lead(2+);sulfate is sourced from PubChem (CID 173462631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).