diethoxy(methoxy)alumane

C5H13AlO3 — CID 16703596

IUPACdiethoxy(methoxy)alumane
SMILESCCO[Al](OC)OCC
InChIInChI=1S/2C2H5O.CH3O.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H3;/q3*-1;+3
InChIKeyWFHLHBKPFHAIHQ-UHFFFAOYSA-N
MW148.14 g/mol
LogP0.69
Rot. Bonds5

About diethoxy(methoxy)alumane

diethoxy(methoxy)alumane (PubChem CID 16703596) has the molecular formula C5H13AlO3 and a molecular weight of 148.14 g/mol. Its IUPAC name is diethoxy(methoxy)alumane.

Molecular Properties

Compound Namediethoxy(methoxy)alumane
PubChem CID16703596
Molecular FormulaC5H13AlO3
Molecular Weight148.14 g/mol
Exact Mass148.07
IUPAC Namediethoxy(methoxy)alumane
SMILESCCO[Al](OC)OCC
InChIInChI=1S/2C2H5O.CH3O.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H3;/q3*-1;+3
InChIKeyWFHLHBKPFHAIHQ-UHFFFAOYSA-N
XLogP0.69
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Aluminum ethylate
CID 11153
Ethoxydiethylaluminium
CID 16683109
Aluminiumalkoholat
CID 16685041
Ethylaluminum diethoxide
CID 16687492
CID 16687730
CID 16687730
LiAlH2(OEt)2
CID 16688255
Diethoxyaluminum chloride
CID 16688437
Aluminium fluoride ethoxide (1/1/2)
CID 16699585
Aluminum;ethanolate;chloride
CID 170842416
Sodium triethoxy-aluminohydride
CID 129804789
Ethoxy(dimethyl)alumane
CID 16687770
Bromo(diethoxy)alumane
CID 16693048

Frequently Asked Questions

What is the IUPAC name of diethoxy(methoxy)alumane?
The IUPAC name of diethoxy(methoxy)alumane (CID 16703596) is diethoxy(methoxy)alumane.
What is the SMILES notation for diethoxy(methoxy)alumane?
The canonical SMILES for diethoxy(methoxy)alumane is CCO[Al](OC)OCC.
What is the InChIKey of diethoxy(methoxy)alumane?
The InChIKey is WFHLHBKPFHAIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5O.CH3O.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H3;/q3*-1;+3.
What are the key properties of diethoxy(methoxy)alumane?
diethoxy(methoxy)alumane has a molecular weight of 148.14 g/mol, XLogP of 0.69, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(methoxy)alumane is sourced from PubChem (CID 16703596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).