dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate

C48H48Cl4Cu2N8O16 — CID 139153017

IUPACdicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate
SMILESCc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Cu+2].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/4C12H12N2.4ClHO4.2Cu/c4*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;4*2-1(3,4)5;;/h4*3-8H,1-2H3;4*(H,2,3,4,5);;/q;;;;;;;;2*+2/p-4
InChIKeyPWSVWLDHMBYMPT-UHFFFAOYSA-J
MW1261.86 g/mol
LogP-7.99
Rot. Bonds4

About dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate

dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate (PubChem CID 139153017) has the molecular formula C48H48Cl4Cu2N8O16 and a molecular weight of 1261.86 g/mol. Its IUPAC name is dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate.

Molecular Properties

Compound Namedicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate
PubChem CID139153017
Molecular FormulaC48H48Cl4Cu2N8O16
Molecular Weight1261.86 g/mol
Exact Mass1258.05
IUPAC Namedicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate
SMILESCc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Cu+2].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/4C12H12N2.4ClHO4.2Cu/c4*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;4*2-1(3,4)5;;/h4*3-8H,1-2H3;4*(H,2,3,4,5);;/q;;;;;;;;2*+2/p-4
InChIKeyPWSVWLDHMBYMPT-UHFFFAOYSA-J
XLogP-7.99
TPSA472.08 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds4
Heavy Atoms78
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001261.86
LogP ≤ 5-7.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

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Related Compounds

Tris(2,2a(2)-bipyridyl)dichlororuthenium(II) hexahydrate
CID 165340051
Disilver;bis(2-methyl-6-[6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine);bis(trifluoromethanesulfonate)
CID 139177536
Bis(copper(1+));bis(2-methyl-6-[6-[6-(6-methyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine);bis(trifluoromethanesulfonate)
CID 139177538
Tris(2,2'-bipyridyl-N,N')iron(II) diperchlorate
CID 139057872
Tris(2,2'-bipyridine)diperchloratoruthenium
CID 139144531
dizinc;bis(N'-[(Z)-[amino-(6-pyridin-2-yl-2-pyridinyl)methylidene]amino]-6-pyridin-2-ylpyridine-2-carboximidamide);tetraperchlorate
CID 139045230
bis(N'-[(Z)-[amino-(6-pyridin-2-yl-2-pyridinyl)methylidene]amino]-6-pyridin-2-ylpyridine-2-carboximidamide);bis(manganese(2+));tetraperchlorate
CID 139045232
bis(2-N',6-N'-bis[(Z)-[amino-(6-pyridin-2-yl-2-pyridinyl)methylidene]amino]pyridine-2,6-dicarboximidamide);manganese;manganese(2+);tetraperchlorate
CID 139045236
bis(6-N'-[(Z)-[amino-[6-[(Z)-N'-[(Z)-[amino-[6-[(Z)-N'-[(Z)-[amino-(6-pyridin-2-yl-2-pyridinyl)methylidene]amino]carbamimidoyl]-2-pyridinyl]methylidene]amino]carbamimidoyl]-2-pyridinyl]methylidene]amino]-2-N'-[(Z)-[amino-(6-pyridin-2-yl-2-pyridinyl)methylidene]amino]pyridine-2,6-dicarboximidamide);pentakis(manganese(2+));decaperchlorate
CID 139045238
ZINC;tris(2-pyridin-2-ylpyridine);diperchlorate
CID 139054418
bis(6,6'-dibromo-2,2'-bipyridyl)copper(I) perchlorate
CID 139056347
mu-oxo-bis[bis(2,2'-bipyridine-kappa^2^N,N')(sulfato-kappaO)iron(III)] undecahydrate
CID 139059937

Frequently Asked Questions

What is the IUPAC name of dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate?
The IUPAC name of dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate (CID 139153017) is dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate.
What is the SMILES notation for dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate?
The canonical SMILES for dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate is Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.Cc1cccc(-c2cccc(C)n2)n1.[Cu+2].[Cu+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate?
The InChIKey is PWSVWLDHMBYMPT-UHFFFAOYSA-J. The full InChI is InChI=1S/4C12H12N2.4ClHO4.2Cu/c4*1-9-5-3-7-11(13-9)12-8-4-6-10(2)14-12;4*2-1(3,4)5;;/h4*3-8H,1-2H3;4*(H,2,3,4,5);;/q;;;;;;;;2*+2/p-4.
What are the key properties of dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate?
dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate has a molecular weight of 1261.86 g/mol, XLogP of -7.99, 4 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for dicopper;tetrakis(2-methyl-6-(6-methyl-2-pyridinyl)pyridine);tetraperchlorate is sourced from PubChem (CID 139153017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).