magnesium;carbanide;2-phenyl-1H-inden-1-ide

C16H14Mg — CID 141374926

IUPACmagnesium;carbanide;2-phenyl-1H-inden-1-ide
SMILES[CH3-].[Mg+2].c1ccc(-c2cc3ccccc3[cH-]2)cc1
InChIInChI=1S/C15H11.CH3.Mg/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;/h1-11H;1H3;/q2*-1;+2
InChIKeySXPDNRPIXFKACI-UHFFFAOYSA-N
MW230.59 g/mol
LogP4.30
Rot. Bonds1

About magnesium;carbanide;2-phenyl-1H-inden-1-ide

magnesium;carbanide;2-phenyl-1H-inden-1-ide (PubChem CID 141374926) has the molecular formula C16H14Mg and a molecular weight of 230.59 g/mol. Its IUPAC name is magnesium;carbanide;2-phenyl-1H-inden-1-ide.

Molecular Properties

Compound Namemagnesium;carbanide;2-phenyl-1H-inden-1-ide
PubChem CID141374926
Molecular FormulaC16H14Mg
Molecular Weight230.59 g/mol
Exact Mass230.09
IUPAC Namemagnesium;carbanide;2-phenyl-1H-inden-1-ide
SMILES[CH3-].[Mg+2].c1ccc(-c2cc3ccccc3[cH-]2)cc1
InChIInChI=1S/C15H11.CH3.Mg/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;/h1-11H;1H3;/q2*-1;+2
InChIKeySXPDNRPIXFKACI-UHFFFAOYSA-N
XLogP4.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.59
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethylidenezirconium(2+);bis(2-phenyl-1H-inden-1-ide)
CID 173282953
dimethylsilylidenetitanium(2+);bis(2-phenyl-1H-inden-1-ide);dichloride
CID 87100881
bis(2-(4-fluorophenyl)-1H-inden-1-ide);titanium(2+)
CID 161430637
dimethylsilylidenezirconium(2+);2-methyl-1H-inden-1-ide;2-phenyl-1H-inden-1-ide;dichloride
CID 18369835
2-methyl-1H-inden-1-ide;2-phenyl-1H-inden-1-ide;propan-2-ylidenezirconium(2+);dichloride
CID 18369824
2-[4-(trifluoromethyl)phenyl]-1H-inden-1-ide;zirconium(3+);dichloride
CID 23216291
bis(2-(3,5-dimethylphenyl)-1H-inden-1-ide);zirconium(4+);dichloride
CID 87971540
difluorozirconium(2+);5-ethyl-1,2,3,4-tetramethylcyclopenta-1,3-diene;2-phenyl-1H-inden-1-ide
CID 154603989
tetrakis(2-(3,5-ditert-butylphenyl)-1H-inden-1-ide);bis(zirconium(2+));dichloride
CID 22283856
carbanide;1-(1H-inden-1-id-2-yl)naphthalene;zirconium(3+)
CID 173277586
2-phenyl-1H-inden-1-ide;1,2,3,5-tetramethyl-4-propylcyclopenta-1,3-diene;zirconium(4+);dichloride
CID 158087222
bis(2-(4-tert-butylphenyl)-1H-inden-1-ide);diethylsilylidenezirconium(2+);dichloride
CID 175882219

Frequently Asked Questions

What is the IUPAC name of magnesium;carbanide;2-phenyl-1H-inden-1-ide?
The IUPAC name of magnesium;carbanide;2-phenyl-1H-inden-1-ide (CID 141374926) is magnesium;carbanide;2-phenyl-1H-inden-1-ide.
What is the SMILES notation for magnesium;carbanide;2-phenyl-1H-inden-1-ide?
The canonical SMILES for magnesium;carbanide;2-phenyl-1H-inden-1-ide is [CH3-].[Mg+2].c1ccc(-c2cc3ccccc3[cH-]2)cc1.
What is the InChIKey of magnesium;carbanide;2-phenyl-1H-inden-1-ide?
The InChIKey is SXPDNRPIXFKACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11.CH3.Mg/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;/h1-11H;1H3;/q2*-1;+2.
What are the key properties of magnesium;carbanide;2-phenyl-1H-inden-1-ide?
magnesium;carbanide;2-phenyl-1H-inden-1-ide has a molecular weight of 230.59 g/mol, XLogP of 4.30, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;carbanide;2-phenyl-1H-inden-1-ide is sourced from PubChem (CID 141374926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).