[(Z)-but-1-enyl]-diethylalumane

C8H17Al — CID 16684063

IUPAC[(Z)-but-1-enyl]-diethylalumane
SMILESCC/C=C\[Al](CC)CC
InChIInChI=1S/C4H7.2C2H5.Al/c1-3-4-2;2*1-2;/h1,3H,4H2,2H3;2*1H2,2H3;
InChIKeyFJUIOMXPUOHENF-UHFFFAOYSA-N
MW140.21 g/mol
LogP3.03
Rot. Bonds4

About [(Z)-but-1-enyl]-diethylalumane

[(Z)-but-1-enyl]-diethylalumane (PubChem CID 16684063) has the molecular formula C8H17Al and a molecular weight of 140.21 g/mol. Its IUPAC name is [(Z)-but-1-enyl]-diethylalumane.

Molecular Properties

Compound Name[(Z)-but-1-enyl]-diethylalumane
PubChem CID16684063
Molecular FormulaC8H17Al
Molecular Weight140.21 g/mol
Exact Mass140.11
IUPAC Name[(Z)-but-1-enyl]-diethylalumane
SMILESCC/C=C\[Al](CC)CC
InChIInChI=1S/C4H7.2C2H5.Al/c1-3-4-2;2*1-2;/h1,3H,4H2,2H3;2*1H2,2H3;
InChIKeyFJUIOMXPUOHENF-UHFFFAOYSA-N
XLogP3.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [(Z)-but-1-enyl]-diethylalumane?
The IUPAC name of [(Z)-but-1-enyl]-diethylalumane (CID 16684063) is [(Z)-but-1-enyl]-diethylalumane.
What is the SMILES notation for [(Z)-but-1-enyl]-diethylalumane?
The canonical SMILES for [(Z)-but-1-enyl]-diethylalumane is CC/C=C\[Al](CC)CC.
What is the InChIKey of [(Z)-but-1-enyl]-diethylalumane?
The InChIKey is FJUIOMXPUOHENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7.2C2H5.Al/c1-3-4-2;2*1-2;/h1,3H,4H2,2H3;2*1H2,2H3;.
What are the key properties of [(Z)-but-1-enyl]-diethylalumane?
[(Z)-but-1-enyl]-diethylalumane has a molecular weight of 140.21 g/mol, XLogP of 3.03, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-but-1-enyl]-diethylalumane is sourced from PubChem (CID 16684063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).