lithium;alumane;1-chlorobutane;hydride

C4H13AlClLi — CID 173447563

IUPAClithium;alumane;1-chlorobutane;hydride
SMILESCCCCCl.[AlH3].[H-].[Li+]
InChIInChI=1S/C4H9Cl.Al.Li.4H/c1-2-3-4-5;;;;;;/h2-4H2,1H3;;;;;;/q;;+1;;;;-1
InChIKeyLTKSYIDWIBWAEA-UHFFFAOYSA-N
MW130.52 g/mol
LogP-2.04
Rot. Bonds2

About lithium;alumane;1-chlorobutane;hydride

lithium;alumane;1-chlorobutane;hydride (PubChem CID 173447563) has the molecular formula C4H13AlClLi and a molecular weight of 130.52 g/mol. Its IUPAC name is lithium;alumane;1-chlorobutane;hydride.

Molecular Properties

Compound Namelithium;alumane;1-chlorobutane;hydride
PubChem CID173447563
Molecular FormulaC4H13AlClLi
Molecular Weight130.52 g/mol
Exact Mass130.07
IUPAC Namelithium;alumane;1-chlorobutane;hydride
SMILESCCCCCl.[AlH3].[H-].[Li+]
InChIInChI=1S/C4H9Cl.Al.Li.4H/c1-2-3-4-5;;;;;;/h2-4H2,1H3;;;;;;/q;;+1;;;;-1
InChIKeyLTKSYIDWIBWAEA-UHFFFAOYSA-N
XLogP-2.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.52
LogP ≤ 5-2.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

magnesium;1-chlorobutane;hydride
CID 172997910
1-chlorobutane
CID 8005
CID 87133310
CID 87133310
alumane;1-chloropentane;hydrate
CID 173313037
1-chlorobutane;chloroform
CID 88838918
1-chlorononane
CID 17185
1-chloropentadecane
CID 20996
1-chloropentane;tetracosane
CID 174427484
1-chloropentane;octacosane
CID 174937871
1-chloropentane;pentadecane
CID 174295582
1-chloropentane;ethane
CID 175284520
1-chloropentane;zirconium;octahydrate
CID 175544911

Frequently Asked Questions

What is the IUPAC name of lithium;alumane;1-chlorobutane;hydride?
The IUPAC name of lithium;alumane;1-chlorobutane;hydride (CID 173447563) is lithium;alumane;1-chlorobutane;hydride.
What is the SMILES notation for lithium;alumane;1-chlorobutane;hydride?
The canonical SMILES for lithium;alumane;1-chlorobutane;hydride is CCCCCl.[AlH3].[H-].[Li+].
What is the InChIKey of lithium;alumane;1-chlorobutane;hydride?
The InChIKey is LTKSYIDWIBWAEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9Cl.Al.Li.4H/c1-2-3-4-5;;;;;;/h2-4H2,1H3;;;;;;/q;;+1;;;;-1.
What are the key properties of lithium;alumane;1-chlorobutane;hydride?
lithium;alumane;1-chlorobutane;hydride has a molecular weight of 130.52 g/mol, XLogP of -2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;alumane;1-chlorobutane;hydride is sourced from PubChem (CID 173447563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).