alumane;hexahydrate;hexahydrochloride

H21AlCl6O6 — CID 175203791

IUPACalumane;hexahydrate;hexahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.O.O.O.O.O.O.[AlH3]
InChIInChI=1S/Al.6ClH.6H2O.3H/h;6*1H;6*1H2;;;
InChIKeyHUWKUEXKPNSERW-UHFFFAOYSA-N
MW356.86 g/mol
LogP-3.60
Rot. Bonds

About alumane;hexahydrate;hexahydrochloride

alumane;hexahydrate;hexahydrochloride (PubChem CID 175203791) has the molecular formula H21AlCl6O6 and a molecular weight of 356.86 g/mol. Its IUPAC name is alumane;hexahydrate;hexahydrochloride.

Molecular Properties

Compound Namealumane;hexahydrate;hexahydrochloride
PubChem CID175203791
Molecular FormulaH21AlCl6O6
Molecular Weight356.86 g/mol
Exact Mass353.93
IUPAC Namealumane;hexahydrate;hexahydrochloride
SMILESCl.Cl.Cl.Cl.Cl.Cl.O.O.O.O.O.O.[AlH3]
InChIInChI=1S/Al.6ClH.6H2O.3H/h;6*1H;6*1H2;;;
InChIKeyHUWKUEXKPNSERW-UHFFFAOYSA-N
XLogP-3.60
TPSA189.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.86
LogP ≤ 5-3.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of alumane;hexahydrate;hexahydrochloride?
The IUPAC name of alumane;hexahydrate;hexahydrochloride (CID 175203791) is alumane;hexahydrate;hexahydrochloride.
What is the SMILES notation for alumane;hexahydrate;hexahydrochloride?
The canonical SMILES for alumane;hexahydrate;hexahydrochloride is Cl.Cl.Cl.Cl.Cl.Cl.O.O.O.O.O.O.[AlH3].
What is the InChIKey of alumane;hexahydrate;hexahydrochloride?
The InChIKey is HUWKUEXKPNSERW-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.6ClH.6H2O.3H/h;6*1H;6*1H2;;;.
What are the key properties of alumane;hexahydrate;hexahydrochloride?
alumane;hexahydrate;hexahydrochloride has a molecular weight of 356.86 g/mol, XLogP of -3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;hexahydrate;hexahydrochloride is sourced from PubChem (CID 175203791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).