alumane;tris(dihydroxy(oxo)silane);hydrate

H14Al2O10Si3 — CID 173089175

IUPACalumane;tris(dihydroxy(oxo)silane);hydrate
SMILESO.O=[Si](O)O.O=[Si](O)O.O=[Si](O)O.[AlH3].[AlH3]
InChIInChI=1S/2Al.3H2O3Si.H2O.6H/c;;3*1-4(2)3;;;;;;;/h;;3*1-2H;1H2;;;;;;
InChIKeyKYJXWKKZDGQBTH-UHFFFAOYSA-N
MW312.32 g/mol
LogP-8.03
Rot. Bonds

About alumane;tris(dihydroxy(oxo)silane);hydrate

alumane;tris(dihydroxy(oxo)silane);hydrate (PubChem CID 173089175) has the molecular formula H14Al2O10Si3 and a molecular weight of 312.32 g/mol. Its IUPAC name is alumane;tris(dihydroxy(oxo)silane);hydrate.

Molecular Properties

Compound Namealumane;tris(dihydroxy(oxo)silane);hydrate
PubChem CID173089175
Molecular FormulaH14Al2O10Si3
Molecular Weight312.32 g/mol
Exact Mass311.95
IUPAC Namealumane;tris(dihydroxy(oxo)silane);hydrate
SMILESO.O=[Si](O)O.O=[Si](O)O.O=[Si](O)O.[AlH3].[AlH3]
InChIInChI=1S/2Al.3H2O3Si.H2O.6H/c;;3*1-4(2)3;;;;;;;/h;;3*1-2H;1H2;;;;;;
InChIKeyKYJXWKKZDGQBTH-UHFFFAOYSA-N
XLogP-8.03
TPSA204.09 Ų
H-Bond Donors6
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.32
LogP ≤ 5-8.03
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of alumane;tris(dihydroxy(oxo)silane);hydrate?
The IUPAC name of alumane;tris(dihydroxy(oxo)silane);hydrate (CID 173089175) is alumane;tris(dihydroxy(oxo)silane);hydrate.
What is the SMILES notation for alumane;tris(dihydroxy(oxo)silane);hydrate?
The canonical SMILES for alumane;tris(dihydroxy(oxo)silane);hydrate is O.O=[Si](O)O.O=[Si](O)O.O=[Si](O)O.[AlH3].[AlH3].
What is the InChIKey of alumane;tris(dihydroxy(oxo)silane);hydrate?
The InChIKey is KYJXWKKZDGQBTH-UHFFFAOYSA-N. The full InChI is InChI=1S/2Al.3H2O3Si.H2O.6H/c;;3*1-4(2)3;;;;;;;/h;;3*1-2H;1H2;;;;;;.
What are the key properties of alumane;tris(dihydroxy(oxo)silane);hydrate?
alumane;tris(dihydroxy(oxo)silane);hydrate has a molecular weight of 312.32 g/mol, XLogP of -8.03, 0 rotatable bonds, 6 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;tris(dihydroxy(oxo)silane);hydrate is sourced from PubChem (CID 173089175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).