oxalate;yttrium(3+)

C2O4Y+ — CID 21124343

IUPACoxalate;yttrium(3+)
SMILESO=C([O-])C(=O)[O-].[Y+3]
InChIInChI=1S/C2H2O4.Y/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+3/p-2
InChIKeyXQWMNFVCVIRCPC-UHFFFAOYSA-L
MW176.92 g/mol
LogP-3.52
Rot. Bonds

About oxalate;yttrium(3+)

oxalate;yttrium(3+) (PubChem CID 21124343) has the molecular formula C2O4Y+ and a molecular weight of 176.92 g/mol. Its IUPAC name is oxalate;yttrium(3+).

Molecular Properties

Compound Nameoxalate;yttrium(3+)
PubChem CID21124343
Molecular FormulaC2O4Y+
Molecular Weight176.92 g/mol
Exact Mass176.88
IUPAC Nameoxalate;yttrium(3+)
SMILESO=C([O-])C(=O)[O-].[Y+3]
InChIInChI=1S/C2H2O4.Y/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+3/p-2
InChIKeyXQWMNFVCVIRCPC-UHFFFAOYSA-L
XLogP-3.52
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.92
LogP ≤ 5-3.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze oxalate;yttrium(3+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

oxalate;bis(yttrium(3+));hydrate
CID 516803
azanium;oxalate;yttrium(3+);hydrate
CID 20835715
oxalate;bis(ruthenium(3+))
CID 57371303
chromium(6+);oxalate
CID 138397959
cerium;oxalate
CID 8762
tetrapotassium;octakis(cadmium(2+));oxalate
CID 173357268
oxalate;platinum(2+)
CID 22066175
oxalate;silicon(4+)
CID 19840044
diazanium;oxalate
CID 14213
cesium oxalate
CID 53436195
dipotassium;zinc;oxalate
CID 173075091
oxalate;rhodium(2+)
CID 22015935

Frequently Asked Questions

What is the IUPAC name of oxalate;yttrium(3+)?
The IUPAC name of oxalate;yttrium(3+) (CID 21124343) is oxalate;yttrium(3+).
What is the SMILES notation for oxalate;yttrium(3+)?
The canonical SMILES for oxalate;yttrium(3+) is O=C([O-])C(=O)[O-].[Y+3].
What is the InChIKey of oxalate;yttrium(3+)?
The InChIKey is XQWMNFVCVIRCPC-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H2O4.Y/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+3/p-2.
What are the key properties of oxalate;yttrium(3+)?
oxalate;yttrium(3+) has a molecular weight of 176.92 g/mol, XLogP of -3.52, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxalate;yttrium(3+) is sourced from PubChem (CID 21124343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).