alumane;butane;hydrofluoride

C4H14AlF — CID 173001006

IUPACalumane;butane;hydrofluoride
SMILESCCCC.F.[AlH3]
InChIInChI=1S/C4H10.Al.FH.3H/c1-3-4-2;;;;;/h3-4H2,1-2H3;;1H;;;
InChIKeyKCSZXYHUSKMWQG-UHFFFAOYSA-N
MW108.14 g/mol
LogP0.77
Rot. Bonds1

About alumane;butane;hydrofluoride

alumane;butane;hydrofluoride (PubChem CID 173001006) has the molecular formula C4H14AlF and a molecular weight of 108.14 g/mol. Its IUPAC name is alumane;butane;hydrofluoride.

Molecular Properties

Compound Namealumane;butane;hydrofluoride
PubChem CID173001006
Molecular FormulaC4H14AlF
Molecular Weight108.14 g/mol
Exact Mass108.09
IUPAC Namealumane;butane;hydrofluoride
SMILESCCCC.F.[AlH3]
InChIInChI=1S/C4H10.Al.FH.3H/c1-3-4-2;;;;;/h3-4H2,1-2H3;;1H;;;
InChIKeyKCSZXYHUSKMWQG-UHFFFAOYSA-N
XLogP0.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze alumane;butane;hydrofluoride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

butane;octahydrofluoride
CID 173254735
butane;pentahydrofluoride
CID 158827877
alumane;butane;dihydrobromide
CID 173417266
butane;dihydroiodide
CID 173299742
butane;methane
CID 169432073
butane;methane
CID 161323740
butane;hydrazine
CID 161056989
azane;butane
CID 18518846
butane;dihydrochloride
CID 175321374
butane;neodymium
CID 173047512
butane;manganese
CID 173124338
butane;sulfane
CID 162203569

Frequently Asked Questions

What is the IUPAC name of alumane;butane;hydrofluoride?
The IUPAC name of alumane;butane;hydrofluoride (CID 173001006) is alumane;butane;hydrofluoride.
What is the SMILES notation for alumane;butane;hydrofluoride?
The canonical SMILES for alumane;butane;hydrofluoride is CCCC.F.[AlH3].
What is the InChIKey of alumane;butane;hydrofluoride?
The InChIKey is KCSZXYHUSKMWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.Al.FH.3H/c1-3-4-2;;;;;/h3-4H2,1-2H3;;1H;;;.
What are the key properties of alumane;butane;hydrofluoride?
alumane;butane;hydrofluoride has a molecular weight of 108.14 g/mol, XLogP of 0.77, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;butane;hydrofluoride is sourced from PubChem (CID 173001006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).