lithium;benzenesulfinic acid;hydride

C6H7LiO2S — CID 173027233

IUPAClithium;benzenesulfinic acid;hydride
SMILESO=S(O)c1ccccc1.[H-].[Li+]
InChIInChI=1S/C6H6O2S.Li.H/c7-9(8)6-4-2-1-3-5-6;;/h1-5H,(H,7,8);;/q;+1;-1
InChIKeyJCDQHDPVWRIDJF-UHFFFAOYSA-N
MW150.13 g/mol
LogP-1.62
Rot. Bonds1

About lithium;benzenesulfinic acid;hydride

lithium;benzenesulfinic acid;hydride (PubChem CID 173027233) has the molecular formula C6H7LiO2S and a molecular weight of 150.13 g/mol. Its IUPAC name is lithium;benzenesulfinic acid;hydride.

Molecular Properties

Compound Namelithium;benzenesulfinic acid;hydride
PubChem CID173027233
Molecular FormulaC6H7LiO2S
Molecular Weight150.13 g/mol
Exact Mass150.03
IUPAC Namelithium;benzenesulfinic acid;hydride
SMILESO=S(O)c1ccccc1.[H-].[Li+]
InChIInChI=1S/C6H6O2S.Li.H/c7-9(8)6-4-2-1-3-5-6;;/h1-5H,(H,7,8);;/q;+1;-1
InChIKeyJCDQHDPVWRIDJF-UHFFFAOYSA-N
XLogP-1.62
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.13
LogP ≤ 5-1.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of lithium;benzenesulfinic acid;hydride?
The IUPAC name of lithium;benzenesulfinic acid;hydride (CID 173027233) is lithium;benzenesulfinic acid;hydride.
What is the SMILES notation for lithium;benzenesulfinic acid;hydride?
The canonical SMILES for lithium;benzenesulfinic acid;hydride is O=S(O)c1ccccc1.[H-].[Li+].
What is the InChIKey of lithium;benzenesulfinic acid;hydride?
The InChIKey is JCDQHDPVWRIDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O2S.Li.H/c7-9(8)6-4-2-1-3-5-6;;/h1-5H,(H,7,8);;/q;+1;-1.
What are the key properties of lithium;benzenesulfinic acid;hydride?
lithium;benzenesulfinic acid;hydride has a molecular weight of 150.13 g/mol, XLogP of -1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;benzenesulfinic acid;hydride is sourced from PubChem (CID 173027233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).