bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)

C50H54HfN6O6 — CID 139082165

IUPACbis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)
SMILESCN(C)C=O.CN(C)C=O.Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].[Hf+4]
InChIInChI=1S/4C11H11NO.2C3H7NO.Hf/c4*1-7-6-8(2)11(13)10-9(7)4-3-5-12-10;2*1-4(2)3-5;/h4*3-6,13H,1-2H3;2*3H,1-2H3;/q;;;;;;+4/p-4
InChIKeyDCDJEOSXEXODLT-UHFFFAOYSA-J
MW1013.51 g/mol
LogP7.11
Rot. Bonds2

About bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)

bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+) (PubChem CID 139082165) has the molecular formula C50H54HfN6O6 and a molecular weight of 1013.51 g/mol. Its IUPAC name is bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+).

Molecular Properties

Compound Namebis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)
PubChem CID139082165
Molecular FormulaC50H54HfN6O6
Molecular Weight1013.51 g/mol
Exact Mass1014.36
IUPAC Namebis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)
SMILESCN(C)C=O.CN(C)C=O.Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].[Hf+4]
InChIInChI=1S/4C11H11NO.2C3H7NO.Hf/c4*1-7-6-8(2)11(13)10-9(7)4-3-5-12-10;2*1-4(2)3-5;/h4*3-6,13H,1-2H3;2*3H,1-2H3;/q;;;;;;+4/p-4
InChIKeyDCDJEOSXEXODLT-UHFFFAOYSA-J
XLogP7.11
TPSA184.42 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001013.51
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

Tetrakis(quinolin-8-olate);zirconium(4+)
CID 139195714
5,7-Bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;dioxotungsten;7-(4-methylphenyl)-5-[4-(trifluoromethyl)phenyl]quinolin-8-ol
CID 160581931
5,7-Bis(4-methylphenyl)quinolin-8-ol;5,7-bis[4-(trifluoromethyl)phenyl]quinolin-8-ol;bis(5,7-dinaphthalen-1-ylquinolin-8-ol);bis(dioxotungsten)
CID 161054806
Tricopper;hexakis(5,7-dimethylquinolin-8-olate)
CID 139040557
Methoxyoxobis(quinolin-8-olato-kappa^2^N,O)vanadium(V)
CID 139071859
Tetrakis(quinolin-8-olato-kappa^2^N,O)hafnium(IV) toluene disolvate
CID 139077805
Tetrakis(8-quinolinolato-kappa^2^N,O)hafnium(IV) dimethylformamide solvate monohydrate
CID 139078843
cyclo-Tetrakis{mu-N'-[(8-oxidoquinolin-7-yl)methylidene]isonicotinohydrazidato}tetrazinc tetrahydrate
CID 139083911
1,1-bis[kappa-O,N-(8-oxyquinolinato)]silacyclohexane
CID 139102092
[Nitrilotris(3,5-di-tert-butyl-2-cresolato)](8-oxyquinolinato)titanium(IV) acetonitrile hemibenzene solvate
CID 139126214
bis(7-(morpholin-4-ylmethyl)quinolin-8-ol)-bis-(mu-2-(7-(morpholin-4-ylmethyl)quinolin-8-ol)-di-copper(II) tetrachlorid dimethanol solvate dihydrate
CID 139173665
bis(7-(piperidin-1-ylmethyl)quinolin-8-ol)-copper(II) dichlorid
CID 139173667

Frequently Asked Questions

What is the IUPAC name of bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)?
The IUPAC name of bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+) (CID 139082165) is bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+).
What is the SMILES notation for bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)?
The canonical SMILES for bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+) is CN(C)C=O.CN(C)C=O.Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].Cc1cc(C)c2cccnc2c1[O-].[Hf+4].
What is the InChIKey of bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)?
The InChIKey is DCDJEOSXEXODLT-UHFFFAOYSA-J. The full InChI is InChI=1S/4C11H11NO.2C3H7NO.Hf/c4*1-7-6-8(2)11(13)10-9(7)4-3-5-12-10;2*1-4(2)3-5;/h4*3-6,13H,1-2H3;2*3H,1-2H3;/q;;;;;;+4/p-4.
What are the key properties of bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+)?
bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+) has a molecular weight of 1013.51 g/mol, XLogP of 7.11, 2 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N,N-dimethylformamide);tetrakis(5,7-dimethylquinolin-8-olate);hafnium(4+) is sourced from PubChem (CID 139082165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).