chloro-bis(2-methylbutyl)alumane

C10H22AlCl — CID 12705533

IUPACchloro-bis(2-methylbutyl)alumane
SMILESCCC(C)C[Al](Cl)CC(C)CC
InChIInChI=1S/2C5H11.Al.ClH/c2*1-4-5(2)3;;/h2*5H,2,4H2,1,3H3;;1H/q;;+1;/p-1
InChIKeyMXQXHNRTQXTQHY-UHFFFAOYSA-M
MW204.72 g/mol
LogP4.31
Rot. Bonds6

About chloro-bis(2-methylbutyl)alumane

chloro-bis(2-methylbutyl)alumane (PubChem CID 12705533) has the molecular formula C10H22AlCl and a molecular weight of 204.72 g/mol. Its IUPAC name is chloro-bis(2-methylbutyl)alumane.

Molecular Properties

Compound Namechloro-bis(2-methylbutyl)alumane
PubChem CID12705533
Molecular FormulaC10H22AlCl
Molecular Weight204.72 g/mol
Exact Mass204.12
IUPAC Namechloro-bis(2-methylbutyl)alumane
SMILESCCC(C)C[Al](Cl)CC(C)CC
InChIInChI=1S/2C5H11.Al.ClH/c2*1-4-5(2)3;;/h2*5H,2,4H2,1,3H3;;1H/q;;+1;/p-1
InChIKeyMXQXHNRTQXTQHY-UHFFFAOYSA-M
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.72
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

dichloro(2-methylbutyl)alumane
CID 12705539
chloro-bis(2-methylpropyl)alumane;hexane
CID 174808933
ethane;3-methylpentane
CID 91147782
3-methylpentane;hydrate
CID 144914279
methane;3-methylpentane
CID 157218592
3-methylpentane;propane
CID 123266773
methane;3-methylpentane
CID 153359275
2-chlorobutane;silane
CID 174414093
2-chloro-4-methylhex-1-ene
CID 15153636
3,5-dimethylheptane;ethane
CID 172617343
CID 118356908
CID 118356908
dichloro(2-methylbutyl)borane
CID 119096300

Frequently Asked Questions

What is the IUPAC name of chloro-bis(2-methylbutyl)alumane?
The IUPAC name of chloro-bis(2-methylbutyl)alumane (CID 12705533) is chloro-bis(2-methylbutyl)alumane.
What is the SMILES notation for chloro-bis(2-methylbutyl)alumane?
The canonical SMILES for chloro-bis(2-methylbutyl)alumane is CCC(C)C[Al](Cl)CC(C)CC.
What is the InChIKey of chloro-bis(2-methylbutyl)alumane?
The InChIKey is MXQXHNRTQXTQHY-UHFFFAOYSA-M. The full InChI is InChI=1S/2C5H11.Al.ClH/c2*1-4-5(2)3;;/h2*5H,2,4H2,1,3H3;;1H/q;;+1;/p-1.
What are the key properties of chloro-bis(2-methylbutyl)alumane?
chloro-bis(2-methylbutyl)alumane has a molecular weight of 204.72 g/mol, XLogP of 4.31, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(2-methylbutyl)alumane is sourced from PubChem (CID 12705533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).