calcium;alumane;hydride;methane

CH9AlCa — CID 173227938

IUPACcalcium;alumane;hydride;methane
SMILESC.[AlH3].[Ca+2].[H-].[H-]
InChIInChI=1S/CH4.Al.Ca.5H/h1H4;;;;;;;/q;;+2;;;;2*-1
InChIKeyCFIXGXQHXSXKSA-UHFFFAOYSA-N
MW88.14 g/mol
LogP-0.70
Rot. Bonds

About calcium;alumane;hydride;methane

calcium;alumane;hydride;methane (PubChem CID 173227938) has the molecular formula CH9AlCa and a molecular weight of 88.14 g/mol. Its IUPAC name is calcium;alumane;hydride;methane.

Molecular Properties

Compound Namecalcium;alumane;hydride;methane
PubChem CID173227938
Molecular FormulaCH9AlCa
Molecular Weight88.14 g/mol
Exact Mass88.01
IUPAC Namecalcium;alumane;hydride;methane
SMILESC.[AlH3].[Ca+2].[H-].[H-]
InChIInChI=1S/CH4.Al.Ca.5H/h1H4;;;;;;;/q;;+2;;;;2*-1
InChIKeyCFIXGXQHXSXKSA-UHFFFAOYSA-N
XLogP-0.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.14
LogP ≤ 5-0.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of calcium;alumane;hydride;methane?
The IUPAC name of calcium;alumane;hydride;methane (CID 173227938) is calcium;alumane;hydride;methane.
What is the SMILES notation for calcium;alumane;hydride;methane?
The canonical SMILES for calcium;alumane;hydride;methane is C.[AlH3].[Ca+2].[H-].[H-].
What is the InChIKey of calcium;alumane;hydride;methane?
The InChIKey is CFIXGXQHXSXKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.Al.Ca.5H/h1H4;;;;;;;/q;;+2;;;;2*-1.
What are the key properties of calcium;alumane;hydride;methane?
calcium;alumane;hydride;methane has a molecular weight of 88.14 g/mol, XLogP of -0.70, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;alumane;hydride;methane is sourced from PubChem (CID 173227938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).