ethoxy(dimethoxy)alumane

C4H11AlO3 — CID 16703598

IUPACethoxy(dimethoxy)alumane
SMILESCCO[Al](OC)OC
InChIInChI=1S/C2H5O.2CH3O.Al/c1-2-3;2*1-2;/h2H2,1H3;2*1H3;/q3*-1;+3
InChIKeyPRPHBYLRCOEHOD-UHFFFAOYSA-N
MW134.11 g/mol
LogP0.30
Rot. Bonds4

About ethoxy(dimethoxy)alumane

ethoxy(dimethoxy)alumane (PubChem CID 16703598) has the molecular formula C4H11AlO3 and a molecular weight of 134.11 g/mol. Its IUPAC name is ethoxy(dimethoxy)alumane.

Molecular Properties

Compound Nameethoxy(dimethoxy)alumane
PubChem CID16703598
Molecular FormulaC4H11AlO3
Molecular Weight134.11 g/mol
Exact Mass134.05
IUPAC Nameethoxy(dimethoxy)alumane
SMILESCCO[Al](OC)OC
InChIInChI=1S/C2H5O.2CH3O.Al/c1-2-3;2*1-2;/h2H2,1H3;2*1H3;/q3*-1;+3
InChIKeyPRPHBYLRCOEHOD-UHFFFAOYSA-N
XLogP0.30
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.11
LogP ≤ 50.30
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 ethoxy(dimethoxy)alumane?
The IUPAC name of ethoxy(dimethoxy)alumane (CID 16703598) is ethoxy(dimethoxy)alumane.
What is the SMILES notation for ethoxy(dimethoxy)alumane?
The canonical SMILES for ethoxy(dimethoxy)alumane is CCO[Al](OC)OC.
What is the InChIKey of ethoxy(dimethoxy)alumane?
The InChIKey is PRPHBYLRCOEHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O.2CH3O.Al/c1-2-3;2*1-2;/h2H2,1H3;2*1H3;/q3*-1;+3.
What are the key properties of ethoxy(dimethoxy)alumane?
ethoxy(dimethoxy)alumane has a molecular weight of 134.11 g/mol, XLogP of 0.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(dimethoxy)alumane is sourced from PubChem (CID 16703598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).