dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide

C16H13Cl2Ru- — CID 150866030

IUPACdichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide
SMILESCc1cc2cc(-c3ccccc3)ccc2[cH-]1.Cl[Ru]Cl
InChIInChI=1S/C16H13.2ClH.Ru/c1-12-9-14-7-8-15(11-16(14)10-12)13-5-3-2-4-6-13;;;/h2-11H,1H3;2*1H;/q-1;;;+2/p-2
InChIKeyAKWZWIIFAKEOLJ-UHFFFAOYSA-L
MW377.26 g/mol
LogP5.91
Rot. Bonds1

About dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide

dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide (PubChem CID 150866030) has the molecular formula C16H13Cl2Ru- and a molecular weight of 377.26 g/mol. Its IUPAC name is dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide.

Molecular Properties

Compound Namedichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide
PubChem CID150866030
Molecular FormulaC16H13Cl2Ru-
Molecular Weight377.26 g/mol
Exact Mass376.94
IUPAC Namedichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide
SMILESCc1cc2cc(-c3ccccc3)ccc2[cH-]1.Cl[Ru]Cl
InChIInChI=1S/C16H13.2ClH.Ru/c1-12-9-14-7-8-15(11-16(14)10-12)13-5-3-2-4-6-13;;;/h2-11H,1H3;2*1H;/q-1;;;+2/p-2
InChIKeyAKWZWIIFAKEOLJ-UHFFFAOYSA-L
XLogP5.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.26
LogP ≤ 55.91
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

CID 173308427
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chromium(2+);bis(2-methyl-1H-inden-1-ide)
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CID 157447863
2-(4-methylphenyl)-7-phenylnaphthalene
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dimethylsilylidenezirconium(2+);2-methyl-1H-inden-1-ide;2-phenyl-1H-inden-1-ide;dichloride
CID 18369835
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CID 157150414
2-methyl-1H-inden-1-ide;2-phenyl-1H-inden-1-ide;propan-2-ylidenezirconium(2+);dichloride
CID 18369824
5-tert-butyl-2-methyl-1H-inden-1-ide;dichlorozirconium
CID 173263456
dichloro(dimethylsilylidene)hafnium;bis(2-methyl-1H-inden-1-ide)
CID 173126666
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CID 132989110
CID 87864757
CID 87864757

Frequently Asked Questions

What is the IUPAC name of dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide?
The IUPAC name of dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide (CID 150866030) is dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide.
What is the SMILES notation for dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide?
The canonical SMILES for dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide is Cc1cc2cc(-c3ccccc3)ccc2[cH-]1.Cl[Ru]Cl.
What is the InChIKey of dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide?
The InChIKey is AKWZWIIFAKEOLJ-UHFFFAOYSA-L. The full InChI is InChI=1S/C16H13.2ClH.Ru/c1-12-9-14-7-8-15(11-16(14)10-12)13-5-3-2-4-6-13;;;/h2-11H,1H3;2*1H;/q-1;;;+2/p-2.
What are the key properties of dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide?
dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide has a molecular weight of 377.26 g/mol, XLogP of 5.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlororuthenium;2-methyl-5-phenyl-1H-inden-1-ide is sourced from PubChem (CID 150866030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).