4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)

C20H12F2N2O2Pt — CID 86298558

IUPAC4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)
SMILES[O-]c1ccc(F)cc1/C=N/c1ccccc1/N=C/c1cc(F)ccc1[O-].[Pt+2]
InChIInChI=1S/C20H14F2N2O2.Pt/c21-15-5-7-19(25)13(9-15)11-23-17-3-1-2-4-18(17)24-12-14-10-16(22)6-8-20(14)26;/h1-12,25-26H;/q;+2/p-2/b23-11+,24-12+;
InChIKeyFQIZJFQKZLYNNV-HGBIREINSA-L
MW545.40 g/mol
LogP3.61
Rot. Bonds4

About 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)

4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+) (PubChem CID 86298558) has the molecular formula C20H12F2N2O2Pt and a molecular weight of 545.40 g/mol. Its IUPAC name is 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+).

Molecular Properties

Compound Name4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)
PubChem CID86298558
Molecular FormulaC20H12F2N2O2Pt
Molecular Weight545.40 g/mol
Exact Mass545.05
IUPAC Name4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)
SMILES[O-]c1ccc(F)cc1/C=N/c1ccccc1/N=C/c1cc(F)ccc1[O-].[Pt+2]
InChIInChI=1S/C20H14F2N2O2.Pt/c21-15-5-7-19(25)13(9-15)11-23-17-3-1-2-4-18(17)24-12-14-10-16(22)6-8-20(14)26;/h1-12,25-26H;/q;+2/p-2/b23-11+,24-12+;
InChIKeyFQIZJFQKZLYNNV-HGBIREINSA-L
XLogP3.61
TPSA70.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500545.40
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

nickel;2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate
CID 58725494
bis(2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate);uranium(4+)
CID 139115041
1-(5-fluoro-2-phenylphenyl)-N-(2-iodophenyl)methanimine
CID 102078012
1-(2,5-difluorophenyl)-N-phenylmethanimine
CID 23340889
N-(2-fluorophenyl)-1-(4-fluorophenyl)methanimine
CID 23329235
2-[(2-chloro-4-fluorophenyl)iminomethyl]phenol
CID 135595437
4-nitro-2-[[2-[2-[2-[2-[2-[(5-nitro-2-oxidophenyl)methylideneamino]phenoxy]ethoxy]ethoxy]ethoxy]phenyl]iminomethyl]phenolate
CID 7072618
methanol;tetrakis(4-methyl-2-[(2-oxidophenyl)methylideneamino]phenolate);tetrakis(nickel(2+))
CID 139177480
copper;5-hydroxy-2-[[2-[(4-hydroxy-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;methanol
CID 139078092
2-[[4,5-dimethoxy-2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate
CID 101450590
tetrakis(2,6-dimethylphenolate);bis(2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate);bis(titanium(4+))
CID 139136922
4-fluoro-2-[(E)-pyridin-2-yliminomethyl]phenol
CID 135908107

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)?
The IUPAC name of 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+) (CID 86298558) is 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+).
What is the SMILES notation for 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)?
The canonical SMILES for 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+) is [O-]c1ccc(F)cc1/C=N/c1ccccc1/N=C/c1cc(F)ccc1[O-].[Pt+2].
What is the InChIKey of 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)?
The InChIKey is FQIZJFQKZLYNNV-HGBIREINSA-L. The full InChI is InChI=1S/C20H14F2N2O2.Pt/c21-15-5-7-19(25)13(9-15)11-23-17-3-1-2-4-18(17)24-12-14-10-16(22)6-8-20(14)26;/h1-12,25-26H;/q;+2/p-2/b23-11+,24-12+;.
What are the key properties of 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+)?
4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+) has a molecular weight of 545.40 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[[2-[(5-fluoro-2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;platinum(2+) is sourced from PubChem (CID 86298558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).