tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium

C44H36Cl8DyN5O4 — CID 139051209

IUPACtetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium
SMILESCC[N+](CC)(CC)CC.[Dy+3].[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12
InChIInChI=1S/4C9H5Cl2NO.C8H20N.Dy/c4*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;1-5-9(6-2,7-3)8-4;/h4*1-4,13H;5-8H2,1-4H3;/q;;;;+1;+3/p-4
InChIKeyBOWIBHGRVMDTDO-UHFFFAOYSA-J
MW1144.93 g/mol
LogP12.34
Rot. Bonds4

About tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium

tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium (PubChem CID 139051209) has the molecular formula C44H36Cl8DyN5O4 and a molecular weight of 1144.93 g/mol. Its IUPAC name is tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium.

Molecular Properties

Compound Nametetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium
PubChem CID139051209
Molecular FormulaC44H36Cl8DyN5O4
Molecular Weight1144.93 g/mol
Exact Mass1141.96
IUPAC Nametetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium
SMILESCC[N+](CC)(CC)CC.[Dy+3].[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12
InChIInChI=1S/4C9H5Cl2NO.C8H20N.Dy/c4*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;1-5-9(6-2,7-3)8-4;/h4*1-4,13H;5-8H2,1-4H3;/q;;;;+1;+3/p-4
InChIKeyBOWIBHGRVMDTDO-UHFFFAOYSA-J
XLogP12.34
TPSA143.80 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001144.93
LogP ≤ 512.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

Halquinol
CID 24690
Tris(5,7-dichloroquinolin-8-olato-N1,O8)aluminium
CID 16685322
Aluminum tris(5,7-dichloroquinolin-8-olate)
CID 22660347
Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
(7-Chloro-5-fluoroquinolin-8-yl)oxy-bis[(5-fluoroquinolin-8-yl)oxy]alumane
CID 58068087
CID 6338312
CID 6338312
CID 58090172
CID 58090172
sodium;tetrakis(5,7-dichloroquinolin-8-olate);N,N-dimethylformamide;dysprosium(3+)
CID 139051207
Dipotassium;tetrakis(acetonitrile);hexadecakis(5,7-dichloroquinolin-8-olate);tetrakis(dysprosium(3+));bis(tetraethylazanium)
CID 139051208
Methoxyoxobis(quinolin-8-olato-kappa^2^N,O)vanadium(V)
CID 139071859
Bis(5-chloroquinolin-8-olato-kappa^2^N,O)bis(propan-2-olato-kappaO)titanium(IV)
CID 139076092
Tetrakis(quinolin-8-olato-kappa^2^N,O)hafnium(IV) toluene disolvate
CID 139077805

Frequently Asked Questions

What is the IUPAC name of tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium?
The IUPAC name of tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium (CID 139051209) is tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium.
What is the SMILES notation for tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium?
The canonical SMILES for tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium is CC[N+](CC)(CC)CC.[Dy+3].[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.[O-]c1c(Cl)cc(Cl)c2cccnc12.
What is the InChIKey of tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium?
The InChIKey is BOWIBHGRVMDTDO-UHFFFAOYSA-J. The full InChI is InChI=1S/4C9H5Cl2NO.C8H20N.Dy/c4*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;1-5-9(6-2,7-3)8-4;/h4*1-4,13H;5-8H2,1-4H3;/q;;;;+1;+3/p-4.
What are the key properties of tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium?
tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium has a molecular weight of 1144.93 g/mol, XLogP of 12.34, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(5,7-dichloroquinolin-8-olate);dysprosium(3+);tetraethylazanium is sourced from PubChem (CID 139051209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).