triethoxyalumane

C18H45Al3O9 — CID 141061757

IUPACtriethoxyalumane
SMILESCCO[Al](OCC)OCC.CCO[Al](OCC)OCC.CCO[Al](OCC)OCC
InChIInChI=1S/9C2H5O.3Al/c9*1-2-3;;;/h9*2H2,1H3;;;/q9*-1;3*+3
InChIKeyPULINHUZDHPFQT-UHFFFAOYSA-N
MW486.50 g/mol
LogP3.24
Rot. Bonds18

About triethoxyalumane

triethoxyalumane (PubChem CID 141061757) has the molecular formula C18H45Al3O9 and a molecular weight of 486.50 g/mol. Its IUPAC name is triethoxyalumane.

Molecular Properties

Compound Nametriethoxyalumane
PubChem CID141061757
Molecular FormulaC18H45Al3O9
Molecular Weight486.50 g/mol
Exact Mass486.25
IUPAC Nametriethoxyalumane
SMILESCCO[Al](OCC)OCC.CCO[Al](OCC)OCC.CCO[Al](OCC)OCC
InChIInChI=1S/9C2H5O.3Al/c9*1-2-3;;;/h9*2H2,1H3;;;/q9*-1;3*+3
InChIKeyPULINHUZDHPFQT-UHFFFAOYSA-N
XLogP3.24
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.50
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

sodium triethoxyalumane
CID 57452515
CID 87119276
CID 87119276
[ethoxy(propanoyloxy)alumanyl] propanoate
CID 88665930
trioctoxyalumane
CID 16712392
propan-2-ol;tripropoxyalumane
CID 159839626
4-[3-aminopropoxy(ethoxy)alumanyl]oxy-4,4-diethoxybutan-1-amine
CID 175292925
ethoxy-methyl-(oxiran-2-yl)alumane
CID 58833483
propane;ruthenium
CID 161061794
ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethoxyethane;triiodoalumane
CID 139244105
4-diethoxyalumanylbutanal
CID 87997439

Frequently Asked Questions

What is the IUPAC name of triethoxyalumane?
The IUPAC name of triethoxyalumane (CID 141061757) is triethoxyalumane.
What is the SMILES notation for triethoxyalumane?
The canonical SMILES for triethoxyalumane is CCO[Al](OCC)OCC.CCO[Al](OCC)OCC.CCO[Al](OCC)OCC.
What is the InChIKey of triethoxyalumane?
The InChIKey is PULINHUZDHPFQT-UHFFFAOYSA-N. The full InChI is InChI=1S/9C2H5O.3Al/c9*1-2-3;;;/h9*2H2,1H3;;;/q9*-1;3*+3.
What are the key properties of triethoxyalumane?
triethoxyalumane has a molecular weight of 486.50 g/mol, XLogP of 3.24, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxyalumane is sourced from PubChem (CID 141061757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).