bis(dysprosium(3+));tris(pentane-2,4-diolate)

C15H30Dy2O6 — CID 173131717

IUPACbis(dysprosium(3+));tris(pentane-2,4-diolate)
SMILESCC([O-])CC(C)[O-].CC([O-])CC(C)[O-].CC([O-])CC(C)[O-].[Dy+3].[Dy+3]
InChIInChI=1S/3C5H10O2.2Dy/c3*1-4(6)3-5(2)7;;/h3*4-5H,3H2,1-2H3;;/q3*-2;2*+3
InChIKeyUYNSNMZDSKUCPN-UHFFFAOYSA-N
MW631.40 g/mol
LogP-3.38
Rot. Bonds6

About bis(dysprosium(3+));tris(pentane-2,4-diolate)

bis(dysprosium(3+));tris(pentane-2,4-diolate) (PubChem CID 173131717) has the molecular formula C15H30Dy2O6 and a molecular weight of 631.40 g/mol. Its IUPAC name is bis(dysprosium(3+));tris(pentane-2,4-diolate).

Molecular Properties

Compound Namebis(dysprosium(3+));tris(pentane-2,4-diolate)
PubChem CID173131717
Molecular FormulaC15H30Dy2O6
Molecular Weight631.40 g/mol
Exact Mass634.06
IUPAC Namebis(dysprosium(3+));tris(pentane-2,4-diolate)
SMILESCC([O-])CC(C)[O-].CC([O-])CC(C)[O-].CC([O-])CC(C)[O-].[Dy+3].[Dy+3]
InChIInChI=1S/3C5H10O2.2Dy/c3*1-4(6)3-5(2)7;;/h3*4-5H,3H2,1-2H3;;/q3*-2;2*+3
InChIKeyUYNSNMZDSKUCPN-UHFFFAOYSA-N
XLogP-3.38
TPSA138.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500631.40
LogP ≤ 5-3.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of bis(dysprosium(3+));tris(pentane-2,4-diolate)?
The IUPAC name of bis(dysprosium(3+));tris(pentane-2,4-diolate) (CID 173131717) is bis(dysprosium(3+));tris(pentane-2,4-diolate).
What is the SMILES notation for bis(dysprosium(3+));tris(pentane-2,4-diolate)?
The canonical SMILES for bis(dysprosium(3+));tris(pentane-2,4-diolate) is CC([O-])CC(C)[O-].CC([O-])CC(C)[O-].CC([O-])CC(C)[O-].[Dy+3].[Dy+3].
What is the InChIKey of bis(dysprosium(3+));tris(pentane-2,4-diolate)?
The InChIKey is UYNSNMZDSKUCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H10O2.2Dy/c3*1-4(6)3-5(2)7;;/h3*4-5H,3H2,1-2H3;;/q3*-2;2*+3.
What are the key properties of bis(dysprosium(3+));tris(pentane-2,4-diolate)?
bis(dysprosium(3+));tris(pentane-2,4-diolate) has a molecular weight of 631.40 g/mol, XLogP of -3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dysprosium(3+));tris(pentane-2,4-diolate) is sourced from PubChem (CID 173131717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).