lithium ethenyl(methyl)phosphinate

C3H6LiO2P — CID 162165650

IUPAClithium ethenyl(methyl)phosphinate
SMILESC=CP(C)(=O)[O-].[Li+]
InChIInChI=1S/C3H7O2P.Li/c1-3-6(2,4)5;/h3H,1H2,2H3,(H,4,5);/q;+1/p-1
InChIKeyRTLHPLWPSYZCQZ-UHFFFAOYSA-M
MW111.99 g/mol
LogP-2.60
Rot. Bonds1

About lithium ethenyl(methyl)phosphinate

lithium ethenyl(methyl)phosphinate (PubChem CID 162165650) has the molecular formula C3H6LiO2P and a molecular weight of 111.99 g/mol. Its IUPAC name is lithium ethenyl(methyl)phosphinate.

Molecular Properties

Compound Namelithium ethenyl(methyl)phosphinate
PubChem CID162165650
Molecular FormulaC3H6LiO2P
Molecular Weight111.99 g/mol
Exact Mass112.03
IUPAC Namelithium ethenyl(methyl)phosphinate
SMILESC=CP(C)(=O)[O-].[Li+]
InChIInChI=1S/C3H7O2P.Li/c1-3-6(2,4)5;/h3H,1H2,2H3,(H,4,5);/q;+1/p-1
InChIKeyRTLHPLWPSYZCQZ-UHFFFAOYSA-M
XLogP-2.60
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.99
LogP ≤ 5-2.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium ethenyl(methyl)phosphinate?
The IUPAC name of lithium ethenyl(methyl)phosphinate (CID 162165650) is lithium ethenyl(methyl)phosphinate.
What is the SMILES notation for lithium ethenyl(methyl)phosphinate?
The canonical SMILES for lithium ethenyl(methyl)phosphinate is C=CP(C)(=O)[O-].[Li+].
What is the InChIKey of lithium ethenyl(methyl)phosphinate?
The InChIKey is RTLHPLWPSYZCQZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H7O2P.Li/c1-3-6(2,4)5;/h3H,1H2,2H3,(H,4,5);/q;+1/p-1.
What are the key properties of lithium ethenyl(methyl)phosphinate?
lithium ethenyl(methyl)phosphinate has a molecular weight of 111.99 g/mol, XLogP of -2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium ethenyl(methyl)phosphinate is sourced from PubChem (CID 162165650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).