copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate

C17H13ClCuN2O6 — CID 139163634

IUPACcopper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate
SMILESO=Cc1ccccc1[O-].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C7H6O2.ClHO4.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-5-6-3-1-2-4-7(6)9;2-1(3,4)5;/h1-8H;1-5,9H;(H,2,3,4,5);/q;;;+2/p-2
InChIKeyBFXVIVQXXULUHU-UHFFFAOYSA-L
MW440.30 g/mol
LogP-2.04
Rot. Bonds2

About copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate

copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate (PubChem CID 139163634) has the molecular formula C17H13ClCuN2O6 and a molecular weight of 440.30 g/mol. Its IUPAC name is copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate.

Molecular Properties

Compound Namecopper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate
PubChem CID139163634
Molecular FormulaC17H13ClCuN2O6
Molecular Weight440.30 g/mol
Exact Mass438.98
IUPAC Namecopper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate
SMILESO=Cc1ccccc1[O-].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C7H6O2.ClHO4.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-5-6-3-1-2-4-7(6)9;2-1(3,4)5;/h1-8H;1-5,9H;(H,2,3,4,5);/q;;;+2/p-2
InChIKeyBFXVIVQXXULUHU-UHFFFAOYSA-L
XLogP-2.04
TPSA158.15 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.30
LogP ≤ 5-2.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

palladium(2+);bis(2-pyridin-2-ylpyridine);diperchlorate
CID 19810782
azane;cobalt(3+);bis(2-pyridin-2-ylpyridine);triperchlorate
CID 139154451
bis(2-formylphenolate);palladium(2+)
CID 165347801
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
perchloric acid;2-pyridin-2-ylpyridine
CID 71352928
bis(dioxido(oxo)phosphanium);platinum(4+);2-pyridin-2-ylpyridine
CID 175964812
manganese(2+);2-pyridin-2-yl-6-(6-pyridin-2-yl-2-pyridinyl)pyridine;diperchlorate;dihydrate
CID 11061040
dicopper;bis(2-pyridin-2-ylpyridine);diselenite;hexahydrate
CID 139126662
copper;2-pyridin-2-ylpyridine;dinitrate;trihydrate
CID 173290754
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113

Frequently Asked Questions

What is the IUPAC name of copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate?
The IUPAC name of copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate (CID 139163634) is copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate.
What is the SMILES notation for copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate?
The canonical SMILES for copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate is O=Cc1ccccc1[O-].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].c1ccc(-c2ccccn2)nc1.
What is the InChIKey of copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate?
The InChIKey is BFXVIVQXXULUHU-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H8N2.C7H6O2.ClHO4.Cu/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;8-5-6-3-1-2-4-7(6)9;2-1(3,4)5;/h1-8H;1-5,9H;(H,2,3,4,5);/q;;;+2/p-2.
What are the key properties of copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate?
copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate has a molecular weight of 440.30 g/mol, XLogP of -2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2-formylphenolate;2-pyridin-2-ylpyridine;perchlorate is sourced from PubChem (CID 139163634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).