carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)

C14H26Ru — CID 167712241

IUPACcarbanide;ethylbenzene;2-methylpropane;ruthenium(2+)
SMILESCC(C)C.CCc1ccccc1.[CH3-].[CH3-].[Ru+2]
InChIInChI=1S/C8H10.C4H10.2CH3.Ru/c1-2-8-6-4-3-5-7-8;1-4(2)3;;;/h3-7H,2H2,1H3;4H,1-3H3;2*1H3;/q;;2*-1;+2
InChIKeyUPMYNSQPINWFRP-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.81
Rot. Bonds1

About carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)

carbanide;ethylbenzene;2-methylpropane;ruthenium(2+) (PubChem CID 167712241) has the molecular formula C14H26Ru and a molecular weight of 295.43 g/mol. Its IUPAC name is carbanide;ethylbenzene;2-methylpropane;ruthenium(2+).

Molecular Properties

Compound Namecarbanide;ethylbenzene;2-methylpropane;ruthenium(2+)
PubChem CID167712241
Molecular FormulaC14H26Ru
Molecular Weight295.43 g/mol
Exact Mass296.11
IUPAC Namecarbanide;ethylbenzene;2-methylpropane;ruthenium(2+)
SMILESCC(C)C.CCc1ccccc1.[CH3-].[CH3-].[Ru+2]
InChIInChI=1S/C8H10.C4H10.2CH3.Ru/c1-2-8-6-4-3-5-7-8;1-4(2)3;;;/h3-7H,2H2,1H3;4H,1-3H3;2*1H3;/q;;2*-1;+2
InChIKeyUPMYNSQPINWFRP-UHFFFAOYSA-N
XLogP4.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.81
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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Frequently Asked Questions

What is the IUPAC name of carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)?
The IUPAC name of carbanide;ethylbenzene;2-methylpropane;ruthenium(2+) (CID 167712241) is carbanide;ethylbenzene;2-methylpropane;ruthenium(2+).
What is the SMILES notation for carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)?
The canonical SMILES for carbanide;ethylbenzene;2-methylpropane;ruthenium(2+) is CC(C)C.CCc1ccccc1.[CH3-].[CH3-].[Ru+2].
What is the InChIKey of carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)?
The InChIKey is UPMYNSQPINWFRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.C4H10.2CH3.Ru/c1-2-8-6-4-3-5-7-8;1-4(2)3;;;/h3-7H,2H2,1H3;4H,1-3H3;2*1H3;/q;;2*-1;+2.
What are the key properties of carbanide;ethylbenzene;2-methylpropane;ruthenium(2+)?
carbanide;ethylbenzene;2-methylpropane;ruthenium(2+) has a molecular weight of 295.43 g/mol, XLogP of 4.81, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethylbenzene;2-methylpropane;ruthenium(2+) is sourced from PubChem (CID 167712241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).