cesium oxalate

C2CsO4- — CID 53436195

IUPACcesium oxalate
SMILESO=C([O-])C(=O)[O-].[Cs+]
InChIInChI=1S/C2H2O4.Cs/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+1/p-2
InChIKeyVYWZGWMEBNSXAD-UHFFFAOYSA-L
MW220.92 g/mol
LogP-6.51
Rot. Bonds

About cesium oxalate

cesium oxalate (PubChem CID 53436195) has the molecular formula C2CsO4- and a molecular weight of 220.92 g/mol. Its IUPAC name is cesium oxalate.

Molecular Properties

Compound Namecesium oxalate
PubChem CID53436195
Molecular FormulaC2CsO4-
Molecular Weight220.92 g/mol
Exact Mass220.89
IUPAC Namecesium oxalate
SMILESO=C([O-])C(=O)[O-].[Cs+]
InChIInChI=1S/C2H2O4.Cs/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+1/p-2
InChIKeyVYWZGWMEBNSXAD-UHFFFAOYSA-L
XLogP-6.51
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.92
LogP ≤ 5-6.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cesium oxalate?
The IUPAC name of cesium oxalate (CID 53436195) is cesium oxalate.
What is the SMILES notation for cesium oxalate?
The canonical SMILES for cesium oxalate is O=C([O-])C(=O)[O-].[Cs+].
What is the InChIKey of cesium oxalate?
The InChIKey is VYWZGWMEBNSXAD-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H2O4.Cs/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+1/p-2.
What are the key properties of cesium oxalate?
cesium oxalate has a molecular weight of 220.92 g/mol, XLogP of -6.51, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cesium oxalate is sourced from PubChem (CID 53436195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).