alumanyloxy(3-methylbutan-2-yl)alumane

C5H14Al2O — CID 173064039

IUPACalumanyloxy(3-methylbutan-2-yl)alumane
SMILESCC(C)C(C)[AlH]O[AlH2]
InChIInChI=1S/C5H11.2Al.O.3H/c1-4-5(2)3;;;;;;/h4-5H,1-3H3;;;;;;
InChIKeyATQZDTXGMABFTL-UHFFFAOYSA-N
MW144.13 g/mol
LogP0.37
Rot. Bonds3

About alumanyloxy(3-methylbutan-2-yl)alumane

alumanyloxy(3-methylbutan-2-yl)alumane (PubChem CID 173064039) has the molecular formula C5H14Al2O and a molecular weight of 144.13 g/mol. Its IUPAC name is alumanyloxy(3-methylbutan-2-yl)alumane.

Molecular Properties

Compound Namealumanyloxy(3-methylbutan-2-yl)alumane
PubChem CID173064039
Molecular FormulaC5H14Al2O
Molecular Weight144.13 g/mol
Exact Mass144.07
IUPAC Namealumanyloxy(3-methylbutan-2-yl)alumane
SMILESCC(C)C(C)[AlH]O[AlH2]
InChIInChI=1S/C5H11.2Al.O.3H/c1-4-5(2)3;;;;;;/h4-5H,1-3H3;;;;;;
InChIKeyATQZDTXGMABFTL-UHFFFAOYSA-N
XLogP0.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of alumanyloxy(3-methylbutan-2-yl)alumane?
The IUPAC name of alumanyloxy(3-methylbutan-2-yl)alumane (CID 173064039) is alumanyloxy(3-methylbutan-2-yl)alumane.
What is the SMILES notation for alumanyloxy(3-methylbutan-2-yl)alumane?
The canonical SMILES for alumanyloxy(3-methylbutan-2-yl)alumane is CC(C)C(C)[AlH]O[AlH2].
What is the InChIKey of alumanyloxy(3-methylbutan-2-yl)alumane?
The InChIKey is ATQZDTXGMABFTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11.2Al.O.3H/c1-4-5(2)3;;;;;;/h4-5H,1-3H3;;;;;;.
What are the key properties of alumanyloxy(3-methylbutan-2-yl)alumane?
alumanyloxy(3-methylbutan-2-yl)alumane has a molecular weight of 144.13 g/mol, XLogP of 0.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for alumanyloxy(3-methylbutan-2-yl)alumane is sourced from PubChem (CID 173064039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).