alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride

H10AlClO12Si3 — CID 173352188

IUPACalumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride
SMILESCl.O=[Si](O)OO.O=[Si](O)OO.O=[Si](O)OO.[AlH3]
InChIInChI=1S/Al.ClH.3H2O4Si.3H/c;;3*1-4-5(2)3;;;/h;1H;3*1-2H;;;
InChIKeyQDPWRJBPNCWGBR-UHFFFAOYSA-N
MW348.76 g/mol
LogP-4.11
Rot. Bonds3

About alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride

alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride (PubChem CID 173352188) has the molecular formula H10AlClO12Si3 and a molecular weight of 348.76 g/mol. Its IUPAC name is alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride.

Molecular Properties

Compound Namealumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride
PubChem CID173352188
Molecular FormulaH10AlClO12Si3
Molecular Weight348.76 g/mol
Exact Mass347.90
IUPAC Namealumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride
SMILESCl.O=[Si](O)OO.O=[Si](O)OO.O=[Si](O)OO.[AlH3]
InChIInChI=1S/Al.ClH.3H2O4Si.3H/c;;3*1-4-5(2)3;;;/h;1H;3*1-2H;;;
InChIKeyQDPWRJBPNCWGBR-UHFFFAOYSA-N
XLogP-4.11
TPSA200.28 Ų
H-Bond Donors6
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.76
LogP ≤ 5-4.11
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

magnesium;hydride;hydroperoxy-hydroxy-oxosilane
CID 173420325
alumane;dihydroxy(oxo)silane;hydroxy-[hydroxy(oxo)silyl]oxy-oxosilane
CID 173133671
dihydroxy(oxo)silane;hydrochloride
CID 173001623
alumane;bis(dihydroxy(oxo)silane)
CID 173307054
dihydroxy(oxo)silane;λ2-plumbane;titanium
CID 173103896
[hydroxy(oxo)silyl] hypochlorite
CID 173148006
dihydroxy(oxo)silane
CID 173025897
dihydroxy(oxo)silane;λ2-plumbane;titanium;tetrahydrate
CID 173072760
calcium;sodium;alumane;dihydroxy(oxo)silane;hydride
CID 173002492
dihydroxy(oxo)silane;yttrium
CID 173082239
CID 173223145
CID 173223145
azane;tris(dihydroxy(oxo)silane)
CID 173008819

Frequently Asked Questions

What is the IUPAC name of alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride?
The IUPAC name of alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride (CID 173352188) is alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride.
What is the SMILES notation for alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride?
The canonical SMILES for alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride is Cl.O=[Si](O)OO.O=[Si](O)OO.O=[Si](O)OO.[AlH3].
What is the InChIKey of alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride?
The InChIKey is QDPWRJBPNCWGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.ClH.3H2O4Si.3H/c;;3*1-4-5(2)3;;;/h;1H;3*1-2H;;;.
What are the key properties of alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride?
alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride has a molecular weight of 348.76 g/mol, XLogP of -4.11, 3 rotatable bonds, 6 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;tris(hydroperoxy-hydroxy-oxosilane);hydrochloride is sourced from PubChem (CID 173352188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).