europium(3+);tris(pyridine-2,6-dicarboxylate)

C21H9EuN3O12-3 — CID 15787725

IUPACeuropium(3+);tris(pyridine-2,6-dicarboxylate)
SMILESO=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.[Eu+3]
InChIInChI=1S/3C7H5NO4.Eu/c3*9-6(10)4-2-1-3-5(8-4)7(11)12;/h3*1-3H,(H,9,10)(H,11,12);/q;;;+3/p-6
InChIKeyCFFUPXCQPPEOEW-UHFFFAOYSA-H
MW647.28 g/mol
LogP-6.57
Rot. Bonds6

About europium(3+);tris(pyridine-2,6-dicarboxylate)

europium(3+);tris(pyridine-2,6-dicarboxylate) (PubChem CID 15787725) has the molecular formula C21H9EuN3O12-3 and a molecular weight of 647.28 g/mol. Its IUPAC name is europium(3+);tris(pyridine-2,6-dicarboxylate).

Molecular Properties

Compound Nameeuropium(3+);tris(pyridine-2,6-dicarboxylate)
PubChem CID15787725
Molecular FormulaC21H9EuN3O12-3
Molecular Weight647.28 g/mol
Exact Mass647.94
IUPAC Nameeuropium(3+);tris(pyridine-2,6-dicarboxylate)
SMILESO=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.[Eu+3]
InChIInChI=1S/3C7H5NO4.Eu/c3*9-6(10)4-2-1-3-5(8-4)7(11)12;/h3*1-3H,(H,9,10)(H,11,12);/q;;;+3/p-6
InChIKeyCFFUPXCQPPEOEW-UHFFFAOYSA-H
XLogP-6.57
TPSA279.45 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500647.28
LogP ≤ 5-6.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

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Related Compounds

2,6-Pyridinedicarboxylic acid
CID 10367
Chromium(III) picolinate
CID 151932
6-Methylpyridine-2-carboxylic acid
CID 70282
Zinc Picolinate
CID 9904746
Chromium picolinate monohydrate
CID 22833491
Dimethyl pyridine-2,6-carboxylate
CID 79549
6-[[2-[(6-Carboxy-2-pyridinyl)methylamino]ethylamino]methyl]pyridine-2-carboxylic acid
CID 58567052
Methyl 6-methylpyridine-2-carboxylate
CID 73022
2,2'-Bipyridine-6,6'-dicarboxylic Acid
CID 9959961
2,6-Pyridine dicarboxylate
CID 5044011
6,6'-(Azanediylbis(methylene))dipicolinic acid
CID 155126357
Dimethyl 2,2'-Bipyridine-6,6'-dicarboxylate
CID 11477388

Frequently Asked Questions

What is the IUPAC name of europium(3+);tris(pyridine-2,6-dicarboxylate)?
The IUPAC name of europium(3+);tris(pyridine-2,6-dicarboxylate) (CID 15787725) is europium(3+);tris(pyridine-2,6-dicarboxylate).
What is the SMILES notation for europium(3+);tris(pyridine-2,6-dicarboxylate)?
The canonical SMILES for europium(3+);tris(pyridine-2,6-dicarboxylate) is O=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.O=C([O-])c1cccc(C(=O)[O-])n1.[Eu+3].
What is the InChIKey of europium(3+);tris(pyridine-2,6-dicarboxylate)?
The InChIKey is CFFUPXCQPPEOEW-UHFFFAOYSA-H. The full InChI is InChI=1S/3C7H5NO4.Eu/c3*9-6(10)4-2-1-3-5(8-4)7(11)12;/h3*1-3H,(H,9,10)(H,11,12);/q;;;+3/p-6.
What are the key properties of europium(3+);tris(pyridine-2,6-dicarboxylate)?
europium(3+);tris(pyridine-2,6-dicarboxylate) has a molecular weight of 647.28 g/mol, XLogP of -6.57, 6 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for europium(3+);tris(pyridine-2,6-dicarboxylate) is sourced from PubChem (CID 15787725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).