azanium;oxalate;yttrium(3+);hydrate

C2H6NO5Y+2 — CID 20835715

IUPACazanium;oxalate;yttrium(3+);hydrate
SMILESO.O=C([O-])C(=O)[O-].[NH4+].[Y+3]
InChIInChI=1S/C2H2O4.H3N.H2O.Y/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);1H3;1H2;/q;;;+3/p-1
InChIKeyFQSFJTPZLRFZFX-UHFFFAOYSA-M
MW212.98 g/mol
LogP-3.96
Rot. Bonds

About azanium;oxalate;yttrium(3+);hydrate

azanium;oxalate;yttrium(3+);hydrate (PubChem CID 20835715) has the molecular formula C2H6NO5Y+2 and a molecular weight of 212.98 g/mol. Its IUPAC name is azanium;oxalate;yttrium(3+);hydrate.

Molecular Properties

Compound Nameazanium;oxalate;yttrium(3+);hydrate
PubChem CID20835715
Molecular FormulaC2H6NO5Y+2
Molecular Weight212.98 g/mol
Exact Mass212.93
IUPAC Nameazanium;oxalate;yttrium(3+);hydrate
SMILESO.O=C([O-])C(=O)[O-].[NH4+].[Y+3]
InChIInChI=1S/C2H2O4.H3N.H2O.Y/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);1H3;1H2;/q;;;+3/p-1
InChIKeyFQSFJTPZLRFZFX-UHFFFAOYSA-M
XLogP-3.96
TPSA148.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.98
LogP ≤ 5-3.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze azanium;oxalate;yttrium(3+);hydrate 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
diazanium;oxalate
CID 14213
tetraazanium oxalate
CID 22167731
oxalate;yttrium(3+)
CID 21124343
bis(nickel(2+));oxalate;dihydrate
CID 172864701
lanthanum;oxalate;nonahydrate
CID 172983604
zinc;oxalate;hexahydrate
CID 175037581
azanium;oxalate;zirconium
CID 87076848
oxalate;bis(terbium(3+));hydrate
CID 57351143
iron(3+);oxalate;hydrate
CID 172796672
bis(cerium(3+));oxalate;decahydrate
CID 71586987
dibismuth;oxalate;heptahydrate
CID 172687404

Frequently Asked Questions

What is the IUPAC name of azanium;oxalate;yttrium(3+);hydrate?
The IUPAC name of azanium;oxalate;yttrium(3+);hydrate (CID 20835715) is azanium;oxalate;yttrium(3+);hydrate.
What is the SMILES notation for azanium;oxalate;yttrium(3+);hydrate?
The canonical SMILES for azanium;oxalate;yttrium(3+);hydrate is O.O=C([O-])C(=O)[O-].[NH4+].[Y+3].
What is the InChIKey of azanium;oxalate;yttrium(3+);hydrate?
The InChIKey is FQSFJTPZLRFZFX-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H2O4.H3N.H2O.Y/c3-1(4)2(5)6;;;/h(H,3,4)(H,5,6);1H3;1H2;/q;;;+3/p-1.
What are the key properties of azanium;oxalate;yttrium(3+);hydrate?
azanium;oxalate;yttrium(3+);hydrate has a molecular weight of 212.98 g/mol, XLogP of -3.96, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;oxalate;yttrium(3+);hydrate is sourced from PubChem (CID 20835715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).