potassium;acetaldehyde;alumane;hydride

C2H8AlKO — CID 173424500

IUPACpotassium;acetaldehyde;alumane;hydride
SMILESCC=O.[AlH3].[H-].[K+]
InChIInChI=1S/C2H4O.Al.K.4H/c1-2-3;;;;;;/h2H,1H3;;;;;;/q;;+1;;;;-1
InChIKeyUBURALWPUYJBEP-UHFFFAOYSA-N
MW114.16 g/mol
LogP-3.86
Rot. Bonds

About potassium;acetaldehyde;alumane;hydride

potassium;acetaldehyde;alumane;hydride (PubChem CID 173424500) has the molecular formula C2H8AlKO and a molecular weight of 114.16 g/mol. Its IUPAC name is potassium;acetaldehyde;alumane;hydride.

Molecular Properties

Compound Namepotassium;acetaldehyde;alumane;hydride
PubChem CID173424500
Molecular FormulaC2H8AlKO
Molecular Weight114.16 g/mol
Exact Mass114.00
IUPAC Namepotassium;acetaldehyde;alumane;hydride
SMILESCC=O.[AlH3].[H-].[K+]
InChIInChI=1S/C2H4O.Al.K.4H/c1-2-3;;;;;;/h2H,1H3;;;;;;/q;;+1;;;;-1
InChIKeyUBURALWPUYJBEP-UHFFFAOYSA-N
XLogP-3.86
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.16
LogP ≤ 5-3.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;acetaldehyde;alumane;hydride?
The IUPAC name of potassium;acetaldehyde;alumane;hydride (CID 173424500) is potassium;acetaldehyde;alumane;hydride.
What is the SMILES notation for potassium;acetaldehyde;alumane;hydride?
The canonical SMILES for potassium;acetaldehyde;alumane;hydride is CC=O.[AlH3].[H-].[K+].
What is the InChIKey of potassium;acetaldehyde;alumane;hydride?
The InChIKey is UBURALWPUYJBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O.Al.K.4H/c1-2-3;;;;;;/h2H,1H3;;;;;;/q;;+1;;;;-1.
What are the key properties of potassium;acetaldehyde;alumane;hydride?
potassium;acetaldehyde;alumane;hydride has a molecular weight of 114.16 g/mol, XLogP of -3.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;acetaldehyde;alumane;hydride is sourced from PubChem (CID 173424500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).