alumanyloxy(pentan-2-yl)alumane

C5H14Al2O — CID 173064142

IUPACalumanyloxy(pentan-2-yl)alumane
SMILESCCCC(C)[AlH]O[AlH2]
InChIInChI=1S/C5H11.2Al.O.3H/c1-3-5-4-2;;;;;;/h3H,4-5H2,1-2H3;;;;;;
InChIKeyYXKDOWLNMFQXMM-UHFFFAOYSA-N
MW144.13 g/mol
LogP0.51
Rot. Bonds4

About alumanyloxy(pentan-2-yl)alumane

alumanyloxy(pentan-2-yl)alumane (PubChem CID 173064142) has the molecular formula C5H14Al2O and a molecular weight of 144.13 g/mol. Its IUPAC name is alumanyloxy(pentan-2-yl)alumane.

Molecular Properties

Compound Namealumanyloxy(pentan-2-yl)alumane
PubChem CID173064142
Molecular FormulaC5H14Al2O
Molecular Weight144.13 g/mol
Exact Mass144.07
IUPAC Namealumanyloxy(pentan-2-yl)alumane
SMILESCCCC(C)[AlH]O[AlH2]
InChIInChI=1S/C5H11.2Al.O.3H/c1-3-5-4-2;;;;;;/h3H,4-5H2,1-2H3;;;;;;
InChIKeyYXKDOWLNMFQXMM-UHFFFAOYSA-N
XLogP0.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

alumanyloxy(3-methylbutan-2-yl)alumane
CID 173064039
hexan-3-yloxyalumane
CID 173043505
4-methylheptane
CID 91413347
4-methylheptane
CID 11512
2-methylpentane
CID 7892
(3R)-3,4-dimethylheptane
CID 59819300
2-methyl-4-(2-methylheptan-4-yloxy)heptane
CID 22758032
ethane;2-methylpentane
CID 143713716
4-methylheptane;propane
CID 142171269
azane;2-methylpentane
CID 18347292
2-methylpentane;hydroiodide
CID 160726714
azane;2-methylpentane
CID 87098569

Frequently Asked Questions

What is the IUPAC name of alumanyloxy(pentan-2-yl)alumane?
The IUPAC name of alumanyloxy(pentan-2-yl)alumane (CID 173064142) is alumanyloxy(pentan-2-yl)alumane.
What is the SMILES notation for alumanyloxy(pentan-2-yl)alumane?
The canonical SMILES for alumanyloxy(pentan-2-yl)alumane is CCCC(C)[AlH]O[AlH2].
What is the InChIKey of alumanyloxy(pentan-2-yl)alumane?
The InChIKey is YXKDOWLNMFQXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11.2Al.O.3H/c1-3-5-4-2;;;;;;/h3H,4-5H2,1-2H3;;;;;;.
What are the key properties of alumanyloxy(pentan-2-yl)alumane?
alumanyloxy(pentan-2-yl)alumane has a molecular weight of 144.13 g/mol, XLogP of 0.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for alumanyloxy(pentan-2-yl)alumane is sourced from PubChem (CID 173064142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).