hexakis(2-methylquinolin-8-olate);tris(palladium(2+))

C60H48N6O6Pd3 — CID 139145173

IUPAChexakis(2-methylquinolin-8-olate);tris(palladium(2+))
SMILESCc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.[Pd+2].[Pd+2].[Pd+2]
InChIInChI=1S/6C10H9NO.3Pd/c6*1-7-5-6-8-3-2-4-9(12)10(8)11-7;;;/h6*2-6,12H,1H3;;;/q;;;;;;3*+2/p-6
InChIKeyAHEAEEQPTHOOPZ-UHFFFAOYSA-H
MW1268.34 g/mol
LogP9.69
Rot. Bonds

About hexakis(2-methylquinolin-8-olate);tris(palladium(2+))

hexakis(2-methylquinolin-8-olate);tris(palladium(2+)) (PubChem CID 139145173) has the molecular formula C60H48N6O6Pd3 and a molecular weight of 1268.34 g/mol. Its IUPAC name is hexakis(2-methylquinolin-8-olate);tris(palladium(2+)).

Molecular Properties

Compound Namehexakis(2-methylquinolin-8-olate);tris(palladium(2+))
PubChem CID139145173
Molecular FormulaC60H48N6O6Pd3
Molecular Weight1268.34 g/mol
Exact Mass1266.07
IUPAC Namehexakis(2-methylquinolin-8-olate);tris(palladium(2+))
SMILESCc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.[Pd+2].[Pd+2].[Pd+2]
InChIInChI=1S/6C10H9NO.3Pd/c6*1-7-5-6-8-3-2-4-9(12)10(8)11-7;;;/h6*2-6,12H,1H3;;;/q;;;;;;3*+2/p-6
InChIKeyAHEAEEQPTHOOPZ-UHFFFAOYSA-H
XLogP9.69
TPSA215.70 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms75
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001268.34
LogP ≤ 59.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Related Compounds

Lithium tetra(2-methyl-8-hydroxyquinolinato)boron
CID 23714786
tri(quinolin-8-yloxy)(111In)indigane
CID 16682728
Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
Tetrakis[(2-methylquinolin-8-yl)oxy]boranuide
CID 4362975
Bis[(2-methylquinolin-8-yl)oxy]-[3-(trifluoromethyl)phenoxy]alumane
CID 57806319
[2,6-Bis(3,5-dimethylphenyl)phenoxy]-bis[(2-methylquinolin-8-yl)oxy]gallane;(2-tert-butylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-ditert-butylphenoxy)-bis[(2-methylquinolin-8-yl)oxy]gallane;(2,6-dimethyl-4-phenylphenoxy)-bis[[2-(trifluoromethyl)quinolin-8-yl]oxy]gallane
CID 157981729
Bis[(2-methylquinolin-8-yl)oxy]gallanyl acetate;bis[(2-methylquinolin-8-yl)oxy]gallanyl 2,2-dimethylpropanoate;bis[(2-methylquinolin-8-yl)oxy]gallanyloxy-bis[(2-methylquinolin-8-yl)oxy]gallane;2-[3,5-bis(3-phenylquinoxalin-2-yl)phenyl]-3-phenylquinoxaline;tris(1,1,1-trifluoroethane)
CID 160193622
CID 16684839
CID 16684839
2-Methyl-8-[5-(2-methylquinolin-8-yl)oxydibenzotellurophen-5-yl]oxyquinoline
CID 134909128
Tricopper;hexakis(5,7-dimethylquinolin-8-olate)
CID 139040557
copper bis(2-[(E)-2-(2-hydroxyphenyl)ethenyl]quinolin-8-olate)
CID 139042208
Bis(2-methyl-8-quinolinolato) Molybdenum
CID 139054921

Frequently Asked Questions

What is the IUPAC name of hexakis(2-methylquinolin-8-olate);tris(palladium(2+))?
The IUPAC name of hexakis(2-methylquinolin-8-olate);tris(palladium(2+)) (CID 139145173) is hexakis(2-methylquinolin-8-olate);tris(palladium(2+)).
What is the SMILES notation for hexakis(2-methylquinolin-8-olate);tris(palladium(2+))?
The canonical SMILES for hexakis(2-methylquinolin-8-olate);tris(palladium(2+)) is Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.Cc1ccc2cccc([O-])c2n1.[Pd+2].[Pd+2].[Pd+2].
What is the InChIKey of hexakis(2-methylquinolin-8-olate);tris(palladium(2+))?
The InChIKey is AHEAEEQPTHOOPZ-UHFFFAOYSA-H. The full InChI is InChI=1S/6C10H9NO.3Pd/c6*1-7-5-6-8-3-2-4-9(12)10(8)11-7;;;/h6*2-6,12H,1H3;;;/q;;;;;;3*+2/p-6.
What are the key properties of hexakis(2-methylquinolin-8-olate);tris(palladium(2+))?
hexakis(2-methylquinolin-8-olate);tris(palladium(2+)) has a molecular weight of 1268.34 g/mol, XLogP of 9.69, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for hexakis(2-methylquinolin-8-olate);tris(palladium(2+)) is sourced from PubChem (CID 139145173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).