magnesium;hexane;hydride

C6H16Mg — CID 173107039

IUPACmagnesium;hexane;hydride
SMILESCCCCCC.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H14.Mg.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1
InChIKeyYMPLSTLXORAUFR-UHFFFAOYSA-N
MW112.50 g/mol
LogP2.43
Rot. Bonds3

About magnesium;hexane;hydride

magnesium;hexane;hydride (PubChem CID 173107039) has the molecular formula C6H16Mg and a molecular weight of 112.50 g/mol. Its IUPAC name is magnesium;hexane;hydride.

Molecular Properties

Compound Namemagnesium;hexane;hydride
PubChem CID173107039
Molecular FormulaC6H16Mg
Molecular Weight112.50 g/mol
Exact Mass112.11
IUPAC Namemagnesium;hexane;hydride
SMILESCCCCCC.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H14.Mg.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1
InChIKeyYMPLSTLXORAUFR-UHFFFAOYSA-N
XLogP2.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.50
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

magnesium;sodium;hydride;tetradecane
CID 173272965
tetralithium;hexane;hydride
CID 174784043
beryllium;hexane;hydride
CID 173045264
sodium;hydride;tridecane
CID 172995973
lithium;dodecane;hydride
CID 173115706
trilithium;hydride;icosane
CID 173415382
magnesium;undecane;dichloride
CID 175829094
sodium;octakis(decane);hydride
CID 173398930
calcium;hydride;octane
CID 173403164
hexane;tungsten
CID 162105258
azane;hexane
CID 18428977
decane;heptane
CID 159049036

Frequently Asked Questions

What is the IUPAC name of magnesium;hexane;hydride?
The IUPAC name of magnesium;hexane;hydride (CID 173107039) is magnesium;hexane;hydride.
What is the SMILES notation for magnesium;hexane;hydride?
The canonical SMILES for magnesium;hexane;hydride is CCCCCC.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hexane;hydride?
The InChIKey is YMPLSTLXORAUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14.Mg.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1.
What are the key properties of magnesium;hexane;hydride?
magnesium;hexane;hydride has a molecular weight of 112.50 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hexane;hydride is sourced from PubChem (CID 173107039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).