Lithium benzoate, 99%

C7H6LiO2 — CID 57451198

IUPAC—
SMILESO=C(O)c1ccccc1.[Li]
InChIInChI=1S/C7H6O2.Li/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);
InChIKeyFGQFWXDBSIBYLO-UHFFFAOYSA-N
MW129.06 g/mol
LogP1.00
Rot. Bonds1

About Lithium benzoate, 99%

Lithium benzoate, 99% (PubChem CID 57451198) has the molecular formula C7H6LiO2 and a molecular weight of 129.06 g/mol.

Molecular Properties

Compound NameLithium benzoate, 99%
PubChem CID57451198
Molecular FormulaC7H6LiO2
Molecular Weight129.06 g/mol
Exact Mass129.05
IUPAC Name—
SMILESO=C(O)c1ccccc1.[Li]
InChIInChI=1S/C7H6O2.Li/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);
InChIKeyFGQFWXDBSIBYLO-UHFFFAOYSA-N
XLogP1.00
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.06
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 67901482
benzoic acid;carbanide;zinc
CID 174738892
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CID 91886363
benzoic acid;zinc;hydrate
CID 70433930

Frequently Asked Questions

What is the IUPAC name of Lithium benzoate, 99%?
The IUPAC name of Lithium benzoate, 99% (CID 57451198) is not available.
What is the SMILES notation for Lithium benzoate, 99%?
The canonical SMILES for Lithium benzoate, 99% is O=C(O)c1ccccc1.[Li].
What is the InChIKey of Lithium benzoate, 99%?
The InChIKey is FGQFWXDBSIBYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O2.Li/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);.
What are the key properties of Lithium benzoate, 99%?
Lithium benzoate, 99% has a molecular weight of 129.06 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Lithium benzoate, 99% is sourced from PubChem (CID 57451198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).