lithium tetrabutylalumanuide

C16H36AlLi — CID 16693939

IUPAClithium tetrabutylalumanuide
SMILESCCCC[Al-](CCCC)(CCCC)CCCC.[Li+]
InChIInChI=1S/4C4H9.Al.Li/c4*1-3-4-2;;/h4*1,3-4H2,2H3;;/q;;;;-1;+1
InChIKeyHZCHVVWPXFHMPH-UHFFFAOYSA-N
MW262.39 g/mol
LogP3.64
Rot. Bonds12

About lithium tetrabutylalumanuide

lithium tetrabutylalumanuide (PubChem CID 16693939) has the molecular formula C16H36AlLi and a molecular weight of 262.39 g/mol. Its IUPAC name is lithium tetrabutylalumanuide.

Molecular Properties

Compound Namelithium tetrabutylalumanuide
PubChem CID16693939
Molecular FormulaC16H36AlLi
Molecular Weight262.39 g/mol
Exact Mass262.28
IUPAC Namelithium tetrabutylalumanuide
SMILESCCCC[Al-](CCCC)(CCCC)CCCC.[Li+]
InChIInChI=1S/4C4H9.Al.Li/c4*1-3-4-2;;/h4*1,3-4H2,2H3;;/q;;;;-1;+1
InChIKeyHZCHVVWPXFHMPH-UHFFFAOYSA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tetrahexylalumanuide
CID 16687628
tetra(nonyl)alumanuide
CID 16706879
trihexyl(octyl)alumanuide
CID 19693696
lithium tetrapropylalumanuide
CID 18764127
tetralithium;hexane;hydride
CID 174784043
lithium;dodecane;hydride
CID 173115706
trilithium;hydride;icosane
CID 173415382
CID 161246447
CID 161246447
zinc pentane
CID 19065630
decane;heptane
CID 159049036
hexane;hydron
CID 174049109
dohexacontane
CID 522644

Frequently Asked Questions

What is the IUPAC name of lithium tetrabutylalumanuide?
The IUPAC name of lithium tetrabutylalumanuide (CID 16693939) is lithium tetrabutylalumanuide.
What is the SMILES notation for lithium tetrabutylalumanuide?
The canonical SMILES for lithium tetrabutylalumanuide is CCCC[Al-](CCCC)(CCCC)CCCC.[Li+].
What is the InChIKey of lithium tetrabutylalumanuide?
The InChIKey is HZCHVVWPXFHMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/4C4H9.Al.Li/c4*1-3-4-2;;/h4*1,3-4H2,2H3;;/q;;;;-1;+1.
What are the key properties of lithium tetrabutylalumanuide?
lithium tetrabutylalumanuide has a molecular weight of 262.39 g/mol, XLogP of 3.64, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium tetrabutylalumanuide is sourced from PubChem (CID 16693939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).