aluminum;ethanolate;dichloride

C2H5AlCl2O — CID 174314145

IUPACaluminum;ethanolate;dichloride
SMILESCC[O-].[Al+3].[Cl-].[Cl-]
InChIInChI=1S/C2H5O.Al.2ClH/c1-2-3;;;/h2H2,1H3;;2*1H/q-1;+3;;/p-2
InChIKeyNPEFICOHWIZPMC-UHFFFAOYSA-L
MW142.95 g/mol
LogP-7.01
Rot. Bonds

About aluminum;ethanolate;dichloride

aluminum;ethanolate;dichloride (PubChem CID 174314145) has the molecular formula C2H5AlCl2O and a molecular weight of 142.95 g/mol. Its IUPAC name is aluminum;ethanolate;dichloride.

Molecular Properties

Compound Namealuminum;ethanolate;dichloride
PubChem CID174314145
Molecular FormulaC2H5AlCl2O
Molecular Weight142.95 g/mol
Exact Mass141.95
IUPAC Namealuminum;ethanolate;dichloride
SMILESCC[O-].[Al+3].[Cl-].[Cl-]
InChIInChI=1S/C2H5O.Al.2ClH/c1-2-3;;;/h2H2,1H3;;2*1H/q-1;+3;;/p-2
InChIKeyNPEFICOHWIZPMC-UHFFFAOYSA-L
XLogP-7.01
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.95
LogP ≤ 5-7.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Hypochlorous acid, ethyl ester
CID 136439
Ethoxydichloroarsine
CID 12549305
Dichloro(ethoxy)alumane
CID 16688829
Ethanolate;titanium(4+);trichloride
CID 21987699
Ethoxytrichlorosilane
CID 4588681
Ethanolate;trichlorotitanium(1+)
CID 13444715
Propoxyaluminum(2+) dichloride
CID 20295750
Ethoxyaluminum(2+) dichloride
CID 22239857
Trichloro(ethoxy)germane
CID 22476946
Trichloro(ethoxy)stannane
CID 22476989
Dichloroalumanylium;ethanolate
CID 87084165
CID 87103624
CID 87103624

Frequently Asked Questions

What is the IUPAC name of aluminum;ethanolate;dichloride?
The IUPAC name of aluminum;ethanolate;dichloride (CID 174314145) is aluminum;ethanolate;dichloride.
What is the SMILES notation for aluminum;ethanolate;dichloride?
The canonical SMILES for aluminum;ethanolate;dichloride is CC[O-].[Al+3].[Cl-].[Cl-].
What is the InChIKey of aluminum;ethanolate;dichloride?
The InChIKey is NPEFICOHWIZPMC-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H5O.Al.2ClH/c1-2-3;;;/h2H2,1H3;;2*1H/q-1;+3;;/p-2.
What are the key properties of aluminum;ethanolate;dichloride?
aluminum;ethanolate;dichloride has a molecular weight of 142.95 g/mol, XLogP of -7.01, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;ethanolate;dichloride is sourced from PubChem (CID 174314145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).