cerium;lanthanum;oxalic acid;praseodymium

C2H2CeLaO4Pr — CID 174586700

IUPACcerium;lanthanum;oxalic acid;praseodymium
SMILESO=C(O)C(=O)O.[Ce].[La].[Pr]
InChIInChI=1S/C2H2O4.Ce.La.Pr/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);;;
InChIKeyIJJOWPBYRRAKHM-UHFFFAOYSA-N
MW509.96 g/mol
LogP-0.84
Rot. Bonds

About cerium;lanthanum;oxalic acid;praseodymium

cerium;lanthanum;oxalic acid;praseodymium (PubChem CID 174586700) has the molecular formula C2H2CeLaO4Pr and a molecular weight of 509.96 g/mol. Its IUPAC name is cerium;lanthanum;oxalic acid;praseodymium.

Molecular Properties

Compound Namecerium;lanthanum;oxalic acid;praseodymium
PubChem CID174586700
Molecular FormulaC2H2CeLaO4Pr
Molecular Weight509.96 g/mol
Exact Mass509.71
IUPAC Namecerium;lanthanum;oxalic acid;praseodymium
SMILESO=C(O)C(=O)O.[Ce].[La].[Pr]
InChIInChI=1S/C2H2O4.Ce.La.Pr/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);;;
InChIKeyIJJOWPBYRRAKHM-UHFFFAOYSA-N
XLogP-0.84
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500509.96
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of cerium;lanthanum;oxalic acid;praseodymium?
The IUPAC name of cerium;lanthanum;oxalic acid;praseodymium (CID 174586700) is cerium;lanthanum;oxalic acid;praseodymium.
What is the SMILES notation for cerium;lanthanum;oxalic acid;praseodymium?
The canonical SMILES for cerium;lanthanum;oxalic acid;praseodymium is O=C(O)C(=O)O.[Ce].[La].[Pr].
What is the InChIKey of cerium;lanthanum;oxalic acid;praseodymium?
The InChIKey is IJJOWPBYRRAKHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2O4.Ce.La.Pr/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);;;.
What are the key properties of cerium;lanthanum;oxalic acid;praseodymium?
cerium;lanthanum;oxalic acid;praseodymium has a molecular weight of 509.96 g/mol, XLogP of -0.84, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cerium;lanthanum;oxalic acid;praseodymium is sourced from PubChem (CID 174586700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).