cyclohexylmethylalumane;hydrochloride

C7H16AlCl — CID 174362292

IUPACcyclohexylmethylalumane;hydrochloride
SMILESCl.[AlH2]CC1CCCCC1
InChIInChI=1S/C7H13.Al.ClH.2H/c1-7-5-3-2-4-6-7;;;;/h7H,1-6H2;;1H;;
InChIKeyXLPJMELUWQPJLR-UHFFFAOYSA-N
MW162.64 g/mol
LogP2.04
Rot. Bonds1

About cyclohexylmethylalumane;hydrochloride

cyclohexylmethylalumane;hydrochloride (PubChem CID 174362292) has the molecular formula C7H16AlCl and a molecular weight of 162.64 g/mol. Its IUPAC name is cyclohexylmethylalumane;hydrochloride.

Molecular Properties

Compound Namecyclohexylmethylalumane;hydrochloride
PubChem CID174362292
Molecular FormulaC7H16AlCl
Molecular Weight162.64 g/mol
Exact Mass162.08
IUPAC Namecyclohexylmethylalumane;hydrochloride
SMILESCl.[AlH2]CC1CCCCC1
InChIInChI=1S/C7H13.Al.ClH.2H/c1-7-5-3-2-4-6-7;;;;/h7H,1-6H2;;1H;;
InChIKeyXLPJMELUWQPJLR-UHFFFAOYSA-N
XLogP2.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.64
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 88545398

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethylalumane;hydrochloride?
The IUPAC name of cyclohexylmethylalumane;hydrochloride (CID 174362292) is cyclohexylmethylalumane;hydrochloride.
What is the SMILES notation for cyclohexylmethylalumane;hydrochloride?
The canonical SMILES for cyclohexylmethylalumane;hydrochloride is Cl.[AlH2]CC1CCCCC1.
What is the InChIKey of cyclohexylmethylalumane;hydrochloride?
The InChIKey is XLPJMELUWQPJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13.Al.ClH.2H/c1-7-5-3-2-4-6-7;;;;/h7H,1-6H2;;1H;;.
What are the key properties of cyclohexylmethylalumane;hydrochloride?
cyclohexylmethylalumane;hydrochloride has a molecular weight of 162.64 g/mol, XLogP of 2.04, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethylalumane;hydrochloride is sourced from PubChem (CID 174362292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).