lithium methyl carbonate

C2H3LiO3 — CID 23677502

IUPAClithium methyl carbonate
SMILESCOC(=O)[O-].[Li+]
InChIInChI=1S/C2H4O3.Li/c1-5-2(3)4;/h1H3,(H,3,4);/q;+1/p-1
InChIKeyGUUWIMCGWXFZKT-UHFFFAOYSA-M
MW81.98 g/mol
LogP-4.02
Rot. Bonds

About lithium methyl carbonate

lithium methyl carbonate (PubChem CID 23677502) has the molecular formula C2H3LiO3 and a molecular weight of 81.98 g/mol. Its IUPAC name is lithium methyl carbonate.

Molecular Properties

Compound Namelithium methyl carbonate
PubChem CID23677502
Molecular FormulaC2H3LiO3
Molecular Weight81.98 g/mol
Exact Mass82.02
IUPAC Namelithium methyl carbonate
SMILESCOC(=O)[O-].[Li+]
InChIInChI=1S/C2H4O3.Li/c1-5-2(3)4;/h1H3,(H,3,4);/q;+1/p-1
InChIKeyGUUWIMCGWXFZKT-UHFFFAOYSA-M
XLogP-4.02
TPSA49.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.98
LogP ≤ 5-4.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

monomethyl carbonate sodium salt
CID 23674761
Methylcarbonate
CID 4585885
Potassium methyl carbonate
CID 23671710
Fluoro methyl carbonate
CID 18542805
Silver methyl carbonate
CID 13411200
CID 5483212
CID 5483212
Iodo methyl carbonate
CID 18511769
Bromo methyl carbonate
CID 20227516
Chloro methyl carbonate
CID 21585157
Cesium methyl carbonate
CID 23683585
Methyl carbonate;rubidium(1+)
CID 23683586
Lithium methoxymethanone
CID 154084308

Frequently Asked Questions

What is the IUPAC name of lithium methyl carbonate?
The IUPAC name of lithium methyl carbonate (CID 23677502) is lithium methyl carbonate.
What is the SMILES notation for lithium methyl carbonate?
The canonical SMILES for lithium methyl carbonate is COC(=O)[O-].[Li+].
What is the InChIKey of lithium methyl carbonate?
The InChIKey is GUUWIMCGWXFZKT-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O3.Li/c1-5-2(3)4;/h1H3,(H,3,4);/q;+1/p-1.
What are the key properties of lithium methyl carbonate?
lithium methyl carbonate has a molecular weight of 81.98 g/mol, XLogP of -4.02, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium methyl carbonate is sourced from PubChem (CID 23677502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).