alumane;oxoalumane

H5Al3O2 — CID 173195330

IUPACalumane;oxoalumane
SMILESO=[AlH].O=[AlH].[AlH3]
InChIInChI=1S/3Al.2O.5H
InChIKeyGQOXGOLKEZGHRL-UHFFFAOYSA-N
MW117.98 g/mol
LogP-2.72
Rot. Bonds

About alumane;oxoalumane

alumane;oxoalumane (PubChem CID 173195330) has the molecular formula H5Al3O2 and a molecular weight of 117.98 g/mol. Its IUPAC name is alumane;oxoalumane.

Molecular Properties

Compound Namealumane;oxoalumane
PubChem CID173195330
Molecular FormulaH5Al3O2
Molecular Weight117.98 g/mol
Exact Mass117.97
IUPAC Namealumane;oxoalumane
SMILESO=[AlH].O=[AlH].[AlH3]
InChIInChI=1S/3Al.2O.5H
InChIKeyGQOXGOLKEZGHRL-UHFFFAOYSA-N
XLogP-2.72
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.98
LogP ≤ 5-2.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of alumane;oxoalumane?
The IUPAC name of alumane;oxoalumane (CID 173195330) is alumane;oxoalumane.
What is the SMILES notation for alumane;oxoalumane?
The canonical SMILES for alumane;oxoalumane is O=[AlH].O=[AlH].[AlH3].
What is the InChIKey of alumane;oxoalumane?
The InChIKey is GQOXGOLKEZGHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/3Al.2O.5H.
What are the key properties of alumane;oxoalumane?
alumane;oxoalumane has a molecular weight of 117.98 g/mol, XLogP of -2.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;oxoalumane is sourced from PubChem (CID 173195330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).