diethoxy(ethyl)alumane

C6H15AlO2 — CID 16687492

IUPACdiethoxy(ethyl)alumane
SMILESCCO[Al](CC)OCC
InChIInChI=1S/2C2H5O.C2H5.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H2,2H3;/q2*-1;;+2
InChIKeyDLRHRQTUCJTIIV-UHFFFAOYSA-N
MW146.17 g/mol
LogP1.57
Rot. Bonds5

About diethoxy(ethyl)alumane

diethoxy(ethyl)alumane (PubChem CID 16687492) has the molecular formula C6H15AlO2 and a molecular weight of 146.17 g/mol. Its IUPAC name is diethoxy(ethyl)alumane.

Molecular Properties

Compound Namediethoxy(ethyl)alumane
PubChem CID16687492
Molecular FormulaC6H15AlO2
Molecular Weight146.17 g/mol
Exact Mass146.09
IUPAC Namediethoxy(ethyl)alumane
SMILESCCO[Al](CC)OCC
InChIInChI=1S/2C2H5O.C2H5.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H2,2H3;/q2*-1;;+2
InChIKeyDLRHRQTUCJTIIV-UHFFFAOYSA-N
XLogP1.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.17
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of diethoxy(ethyl)alumane?
The IUPAC name of diethoxy(ethyl)alumane (CID 16687492) is diethoxy(ethyl)alumane.
What is the SMILES notation for diethoxy(ethyl)alumane?
The canonical SMILES for diethoxy(ethyl)alumane is CCO[Al](CC)OCC.
What is the InChIKey of diethoxy(ethyl)alumane?
The InChIKey is DLRHRQTUCJTIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5O.C2H5.Al/c2*1-2-3;1-2;/h2*2H2,1H3;1H2,2H3;/q2*-1;;+2.
What are the key properties of diethoxy(ethyl)alumane?
diethoxy(ethyl)alumane has a molecular weight of 146.17 g/mol, XLogP of 1.57, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(ethyl)alumane is sourced from PubChem (CID 16687492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).