dichloroalumane;ethanol

C2H7AlCl2O — CID 174743227

IUPACdichloroalumane;ethanol
SMILESCCO.Cl[AlH]Cl
InChIInChI=1S/C2H6O.Al.2ClH.H/c1-2-3;;;;/h3H,2H2,1H3;;2*1H;/q;+2;;;/p-2
InChIKeyLQRQFOFHDYINTQ-UHFFFAOYSA-L
MW144.96 g/mol
LogP0.73
Rot. Bonds

About dichloroalumane;ethanol

dichloroalumane;ethanol (PubChem CID 174743227) has the molecular formula C2H7AlCl2O and a molecular weight of 144.96 g/mol. Its IUPAC name is dichloroalumane;ethanol.

Molecular Properties

Compound Namedichloroalumane;ethanol
PubChem CID174743227
Molecular FormulaC2H7AlCl2O
Molecular Weight144.96 g/mol
Exact Mass143.97
IUPAC Namedichloroalumane;ethanol
SMILESCCO.Cl[AlH]Cl
InChIInChI=1S/C2H6O.Al.2ClH.H/c1-2-3;;;;/h3H,2H2,1H3;;2*1H;/q;+2;;;/p-2
InChIKeyLQRQFOFHDYINTQ-UHFFFAOYSA-L
XLogP0.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.96
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of dichloroalumane;ethanol?
The IUPAC name of dichloroalumane;ethanol (CID 174743227) is dichloroalumane;ethanol.
What is the SMILES notation for dichloroalumane;ethanol?
The canonical SMILES for dichloroalumane;ethanol is CCO.Cl[AlH]Cl.
What is the InChIKey of dichloroalumane;ethanol?
The InChIKey is LQRQFOFHDYINTQ-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H6O.Al.2ClH.H/c1-2-3;;;;/h3H,2H2,1H3;;2*1H;/q;+2;;;/p-2.
What are the key properties of dichloroalumane;ethanol?
dichloroalumane;ethanol has a molecular weight of 144.96 g/mol, XLogP of 0.73, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroalumane;ethanol is sourced from PubChem (CID 174743227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).