2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)

C34H26N6O2Ru — CID 139141168

IUPAC2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)
SMILES[O-]c1ccccc1-c1ccccc1[O-].[Ru+2].c1ccc(/N=N/c2ccccn2)cc1.c1ccc(/N=N/c2ccccn2)cc1
InChIInChI=1S/C12H10O2.2C11H9N3.Ru/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-2-6-10(7-3-1)13-14-11-8-4-5-9-12-11;/h1-8,13-14H;2*1-9H;/q;;;+2/p-2/b;2*14-13+;
InChIKeyIUMVSHOURHPRGR-XVMIXBNESA-L
MW651.69 g/mol
LogP8.49
Rot. Bonds5

About 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)

2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+) (PubChem CID 139141168) has the molecular formula C34H26N6O2Ru and a molecular weight of 651.69 g/mol. Its IUPAC name is 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+).

Molecular Properties

Compound Name2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)
PubChem CID139141168
Molecular FormulaC34H26N6O2Ru
Molecular Weight651.69 g/mol
Exact Mass652.12
IUPAC Name2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)
SMILES[O-]c1ccccc1-c1ccccc1[O-].[Ru+2].c1ccc(/N=N/c2ccccn2)cc1.c1ccc(/N=N/c2ccccn2)cc1
InChIInChI=1S/C12H10O2.2C11H9N3.Ru/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-2-6-10(7-3-1)13-14-11-8-4-5-9-12-11;/h1-8,13-14H;2*1-9H;/q;;;+2/p-2/b;2*14-13+;
InChIKeyIUMVSHOURHPRGR-XVMIXBNESA-L
XLogP8.49
TPSA121.34 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500651.69
LogP ≤ 58.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

bis(nickel(2+));bis(2-[[2-[(E)-(2-oxidophenyl)methylideneamino]-3-pyridinyl]iminomethyl]phenolate)
CID 139056067
Bis{2-[(2-pyridyl)iminomethyl]phenolato}copper(II)
CID 139077095
2,4-Ditert-butyl-6-phenylazanidylphenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(3+);toluene;perchlorate
CID 139127174
2,4-Ditert-butyl-6-phenylazanidylphenolate;osmium(2+);bis(phenyl(pyridin-2-yl)diazene)
CID 139135938
2,4-Ditert-butyl-6-(3,5-ditert-butylphenyl)azanidylphenolate;osmium(2+);bis(phenyl(pyridin-2-yl)diazene)
CID 139135941
Bis(3,5-ditert-butylbenzene-1,2-diolate);bis(phenyl(pyridin-2-yl)diazene);bis(platinum(2+))
CID 139149563
Bis(osmium(2+));bis(2-(2-oxidophenyl)phenolate);tetrakis(phenyl(pyridin-2-yl)diazene)
CID 139168103
Lambda-bis[N-2-(pyridyl)salicylaldiminato-kappa^2^N,O]zinc(II)
CID 139204853
copper;bis(2-[(E)-pyridin-2-yliminomethyl]phenol)
CID 139238731
dioxidanium;manganese(2+);bis(2-[(E)-pyridin-2-yliminomethyl]phenolate)
CID 24202059
copper bis(2-[(E)-(3-methyl-2-pyridinyl)iminomethyl]phenolate)
CID 45049434
7-(6-Phenyl-2-pyridinyl)-6,6-dipyridin-3-ylbenzo[d][1,3,2]benzoxazasilepine
CID 58249906

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)?
The IUPAC name of 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+) (CID 139141168) is 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+).
What is the SMILES notation for 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)?
The canonical SMILES for 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+) is [O-]c1ccccc1-c1ccccc1[O-].[Ru+2].c1ccc(/N=N/c2ccccn2)cc1.c1ccc(/N=N/c2ccccn2)cc1.
What is the InChIKey of 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)?
The InChIKey is IUMVSHOURHPRGR-XVMIXBNESA-L. The full InChI is InChI=1S/C12H10O2.2C11H9N3.Ru/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-2-6-10(7-3-1)13-14-11-8-4-5-9-12-11;/h1-8,13-14H;2*1-9H;/q;;;+2/p-2/b;2*14-13+;.
What are the key properties of 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+)?
2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+) has a molecular weight of 651.69 g/mol, XLogP of 8.49, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxidophenyl)phenolate;bis(phenyl(pyridin-2-yl)diazene);ruthenium(2+) is sourced from PubChem (CID 139141168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).