aluminapentane

C4H9Al — CID 16694997

IUPAC—
SMILESCCCC[Al]
InChIInChI=1S/C4H9.Al/c1-3-4-2;/h1,3-4H2,2H3;
InChIKeyOCFSGVNHPVWWKD-UHFFFAOYSA-N
MW84.10 g/mol
LogP1.37
Rot. Bonds2

About aluminapentane

aluminapentane (PubChem CID 16694997) has the molecular formula C4H9Al and a molecular weight of 84.10 g/mol.

Molecular Properties

Compound Namealuminapentane
PubChem CID16694997
Molecular FormulaC4H9Al
Molecular Weight84.10 g/mol
Exact Mass84.05
IUPAC Name—
SMILESCCCC[Al]
InChIInChI=1S/C4H9.Al/c1-3-4-2;/h1,3-4H2,2H3;
InChIKeyOCFSGVNHPVWWKD-UHFFFAOYSA-N
XLogP1.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.10
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of aluminapentane?
The IUPAC name of aluminapentane (CID 16694997) is not available.
What is the SMILES notation for aluminapentane?
The canonical SMILES for aluminapentane is CCCC[Al].
What is the InChIKey of aluminapentane?
The InChIKey is OCFSGVNHPVWWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9.Al/c1-3-4-2;/h1,3-4H2,2H3;.
What are the key properties of aluminapentane?
aluminapentane has a molecular weight of 84.10 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminapentane is sourced from PubChem (CID 16694997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).