ethyl(hexyl)alumane

C8H19Al — CID 154349327

IUPACethyl(hexyl)alumane
SMILESCCCCCC[AlH]CC
InChIInChI=1S/C6H13.C2H5.Al.H/c1-3-5-6-4-2;1-2;;/h1,3-6H2,2H3;1H2,2H3;;
InChIKeyWAUOXWLQWDSDPO-UHFFFAOYSA-N
MW142.22 g/mol
LogP2.86
Rot. Bonds6

About ethyl(hexyl)alumane

ethyl(hexyl)alumane (PubChem CID 154349327) has the molecular formula C8H19Al and a molecular weight of 142.22 g/mol. Its IUPAC name is ethyl(hexyl)alumane.

Molecular Properties

Compound Nameethyl(hexyl)alumane
PubChem CID154349327
Molecular FormulaC8H19Al
Molecular Weight142.22 g/mol
Exact Mass142.13
IUPAC Nameethyl(hexyl)alumane
SMILESCCCCCC[AlH]CC
InChIInChI=1S/C6H13.C2H5.Al.H/c1-3-5-6-4-2;1-2;;/h1,3-6H2,2H3;1H2,2H3;;
InChIKeyWAUOXWLQWDSDPO-UHFFFAOYSA-N
XLogP2.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.22
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

dihexylalumane;hydrochloride
CID 175022158
dioctylalumane;hexylalumane
CID 175046144
dihexylalumane;N-octyloctan-1-amine
CID 173450934
dibromoalumane;octane
CID 174479691
dibromoalumane;dodecane
CID 174323444
(1,2,3,4,5,6,7,8,9,10,11,12-13C12)dodecane
CID 71309250
dodecane;pentadecane
CID 162065772
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782

Frequently Asked Questions

What is the IUPAC name of ethyl(hexyl)alumane?
The IUPAC name of ethyl(hexyl)alumane (CID 154349327) is ethyl(hexyl)alumane.
What is the SMILES notation for ethyl(hexyl)alumane?
The canonical SMILES for ethyl(hexyl)alumane is CCCCCC[AlH]CC.
What is the InChIKey of ethyl(hexyl)alumane?
The InChIKey is WAUOXWLQWDSDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13.C2H5.Al.H/c1-3-5-6-4-2;1-2;;/h1,3-6H2,2H3;1H2,2H3;;.
What are the key properties of ethyl(hexyl)alumane?
ethyl(hexyl)alumane has a molecular weight of 142.22 g/mol, XLogP of 2.86, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(hexyl)alumane is sourced from PubChem (CID 154349327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).