alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane

H7AlO8Si3 — CID 173133671

IUPACalumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane
SMILESO=[Si](O)O.O=[Si](O)O[Si](=O)O.[AlH3]
InChIInChI=1S/Al.H2O5Si2.H2O3Si.3H/c;1-6(2)5-7(3)4;1-4(2)3;;;/h;1,3H;1-2H;;;
InChIKeyYTQXJUFAOTZEAL-UHFFFAOYSA-N
MW246.29 g/mol
LogP-4.98
Rot. Bonds2

About alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane

alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane (PubChem CID 173133671) has the molecular formula H7AlO8Si3 and a molecular weight of 246.29 g/mol. Its IUPAC name is alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane.

Molecular Properties

Compound Namealumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane
PubChem CID173133671
Molecular FormulaH7AlO8Si3
Molecular Weight246.29 g/mol
Exact Mass245.93
IUPAC Namealumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane
SMILESO=[Si](O)O.O=[Si](O)O[Si](=O)O.[AlH3]
InChIInChI=1S/Al.H2O5Si2.H2O3Si.3H/c;1-6(2)5-7(3)4;1-4(2)3;;;/h;1,3H;1-2H;;;
InChIKeyYTQXJUFAOTZEAL-UHFFFAOYSA-N
XLogP-4.98
TPSA141.36 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-4.98
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane?
The IUPAC name of alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane (CID 173133671) is alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane.
What is the SMILES notation for alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane?
The canonical SMILES for alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane is O=[Si](O)O.O=[Si](O)O[Si](=O)O.[AlH3].
What is the InChIKey of alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane?
The InChIKey is YTQXJUFAOTZEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.H2O5Si2.H2O3Si.3H/c;1-6(2)5-7(3)4;1-4(2)3;;;/h;1,3H;1-2H;;;.
What are the key properties of alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane?
alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane has a molecular weight of 246.29 g/mol, XLogP of -4.98, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane is sourced from PubChem (CID 173133671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).