tetracontaaluminum;hentetracontahydrochloride

H41Al40Cl41+120 — CID 173274187

IUPACtetracontaaluminum;hentetracontahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3]
InChIInChI=1S/40Al.41ClH/h;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;41*1H/q40*+3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyPLIQVLLPCVUQMW-UHFFFAOYSA-N
MW2574.18 g/mol
LogP2.06
Rot. Bonds

About tetracontaaluminum;hentetracontahydrochloride

tetracontaaluminum;hentetracontahydrochloride (PubChem CID 173274187) has the molecular formula H41Al40Cl41+120 and a molecular weight of 2574.18 g/mol. Its IUPAC name is tetracontaaluminum;hentetracontahydrochloride.

Molecular Properties

Compound Nametetracontaaluminum;hentetracontahydrochloride
PubChem CID173274187
Molecular FormulaH41Al40Cl41+120
Molecular Weight2574.18 g/mol
Exact Mass2554.24
IUPAC Nametetracontaaluminum;hentetracontahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3]
InChIInChI=1S/40Al.41ClH/h;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;41*1H/q40*+3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyPLIQVLLPCVUQMW-UHFFFAOYSA-N
XLogP2.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms81
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5002574.18
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 22995166
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CID 173364785
CID 173018152
CID 173018152
hexahydrochloride;dihydroiodide
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CID 173436309
iron;hydrochloride
CID 86633186
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Frequently Asked Questions

What is the IUPAC name of tetracontaaluminum;hentetracontahydrochloride?
The IUPAC name of tetracontaaluminum;hentetracontahydrochloride (CID 173274187) is tetracontaaluminum;hentetracontahydrochloride.
What is the SMILES notation for tetracontaaluminum;hentetracontahydrochloride?
The canonical SMILES for tetracontaaluminum;hentetracontahydrochloride is Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.Cl.[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].
What is the InChIKey of tetracontaaluminum;hentetracontahydrochloride?
The InChIKey is PLIQVLLPCVUQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/40Al.41ClH/h;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;41*1H/q40*+3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of tetracontaaluminum;hentetracontahydrochloride?
tetracontaaluminum;hentetracontahydrochloride has a molecular weight of 2574.18 g/mol, XLogP of 2.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracontaaluminum;hentetracontahydrochloride is sourced from PubChem (CID 173274187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).