di(butan-2-yl)alumane

C8H19Al — CID 2724024

IUPACdi(butan-2-yl)alumane
SMILESCCC(C)[AlH]C(C)CC
InChIInChI=1S/2C4H9.Al.H/c2*1-3-4-2;;/h2*3H,4H2,1-2H3;;
InChIKeyUUDFOWYDKXNYTK-UHFFFAOYSA-N
MW142.22 g/mol
LogP2.86
Rot. Bonds4

About di(butan-2-yl)alumane

di(butan-2-yl)alumane (PubChem CID 2724024) has the molecular formula C8H19Al and a molecular weight of 142.22 g/mol. Its IUPAC name is di(butan-2-yl)alumane.

Molecular Properties

Compound Namedi(butan-2-yl)alumane
PubChem CID2724024
Molecular FormulaC8H19Al
Molecular Weight142.22 g/mol
Exact Mass142.13
IUPAC Namedi(butan-2-yl)alumane
SMILESCCC(C)[AlH]C(C)CC
InChIInChI=1S/2C4H9.Al.H/c2*1-3-4-2;;/h2*3H,4H2,1-2H3;;
InChIKeyUUDFOWYDKXNYTK-UHFFFAOYSA-N
XLogP2.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
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

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Related Compounds

di(butan-2-yl)alumane;zinc
CID 174822809
2-methylbutane
CID 159175971
2-methylbutane
CID 158117812
2-methylbutane;yttrium
CID 157105537
2-methylbutane;nickel
CID 159021520
ethane;3-methylpentane
CID 91147782
ethylazanium;trimethylazanium;diiodide
CID 172824099
methane;3-methylpentane
CID 157218592
bis(3-methanidylpentane);tungsten(2+)
CID 58814797
butane-2-tellurol
CID 173009567
(3R,4R)-3,4-dimethylhexane;methane
CID 159261482
3-methylpentane;hydrate
CID 144914279

Frequently Asked Questions

What is the IUPAC name of di(butan-2-yl)alumane?
The IUPAC name of di(butan-2-yl)alumane (CID 2724024) is di(butan-2-yl)alumane.
What is the SMILES notation for di(butan-2-yl)alumane?
The canonical SMILES for di(butan-2-yl)alumane is CCC(C)[AlH]C(C)CC.
What is the InChIKey of di(butan-2-yl)alumane?
The InChIKey is UUDFOWYDKXNYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H9.Al.H/c2*1-3-4-2;;/h2*3H,4H2,1-2H3;;.
What are the key properties of di(butan-2-yl)alumane?
di(butan-2-yl)alumane has a molecular weight of 142.22 g/mol, XLogP of 2.86, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for di(butan-2-yl)alumane is sourced from PubChem (CID 2724024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).