tetralithium;methane;oxalate

C5H4Li4O8 — CID 174903664

IUPACtetralithium;methane;oxalate
SMILESC.O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Li+].[Li+].[Li+].[Li+]
InChIInChI=1S/2C2H2O4.CH4.4Li/c2*3-1(4)2(5)6;;;;;/h2*(H,3,4)(H,5,6);1H4;;;;/q;;;4*+1/p-4
InChIKeyKWJVONIIYJCBTC-UHFFFAOYSA-J
MW219.84 g/mol
LogP-18.38
Rot. Bonds

About tetralithium;methane;oxalate

tetralithium;methane;oxalate (PubChem CID 174903664) has the molecular formula C5H4Li4O8 and a molecular weight of 219.84 g/mol. Its IUPAC name is tetralithium;methane;oxalate.

Molecular Properties

Compound Nametetralithium;methane;oxalate
PubChem CID174903664
Molecular FormulaC5H4Li4O8
Molecular Weight219.84 g/mol
Exact Mass220.05
IUPAC Nametetralithium;methane;oxalate
SMILESC.O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Li+].[Li+].[Li+].[Li+]
InChIInChI=1S/2C2H2O4.CH4.4Li/c2*3-1(4)2(5)6;;;;;/h2*(H,3,4)(H,5,6);1H4;;;;/q;;;4*+1/p-4
InChIKeyKWJVONIIYJCBTC-UHFFFAOYSA-J
XLogP-18.38
TPSA160.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.84
LogP ≤ 5-18.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

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CID 173348725
lithium;hydron;oxalate
CID 22141737
oxalate;platinum(2+)
CID 22066175
cerium;oxalate
CID 8762
chromium(6+);oxalate
CID 138397959
tetrapotassium;octakis(cadmium(2+));oxalate
CID 173357268
oxalate;silicon(4+)
CID 19840044
diazanium;oxalate
CID 14213
cesium oxalate
CID 53436195
oxalate;bis(ruthenium(3+))
CID 57371303
dipotassium;zinc;oxalate
CID 173075091
oxalate;rhodium(2+)
CID 22015935

Frequently Asked Questions

What is the IUPAC name of tetralithium;methane;oxalate?
The IUPAC name of tetralithium;methane;oxalate (CID 174903664) is tetralithium;methane;oxalate.
What is the SMILES notation for tetralithium;methane;oxalate?
The canonical SMILES for tetralithium;methane;oxalate is C.O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Li+].[Li+].[Li+].[Li+].
What is the InChIKey of tetralithium;methane;oxalate?
The InChIKey is KWJVONIIYJCBTC-UHFFFAOYSA-J. The full InChI is InChI=1S/2C2H2O4.CH4.4Li/c2*3-1(4)2(5)6;;;;;/h2*(H,3,4)(H,5,6);1H4;;;;/q;;;4*+1/p-4.
What are the key properties of tetralithium;methane;oxalate?
tetralithium;methane;oxalate has a molecular weight of 219.84 g/mol, XLogP of -18.38, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetralithium;methane;oxalate is sourced from PubChem (CID 174903664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).