lithium;hydride;2-hydroxyethanesulfonic acid

C2H7LiO4S — CID 173041120

IUPAClithium;hydride;2-hydroxyethanesulfonic acid
SMILESO=S(=O)(O)CCO.[H-].[Li+]
InChIInChI=1S/C2H6O4S.Li.H/c3-1-2-7(4,5)6;;/h3H,1-2H2,(H,4,5,6);;/q;+1;-1
InChIKeyROEVZUVCGZRAHU-UHFFFAOYSA-N
MW134.08 g/mol
LogP-4.02
Rot. Bonds2

About lithium;hydride;2-hydroxyethanesulfonic acid

lithium;hydride;2-hydroxyethanesulfonic acid (PubChem CID 173041120) has the molecular formula C2H7LiO4S and a molecular weight of 134.08 g/mol. Its IUPAC name is lithium;hydride;2-hydroxyethanesulfonic acid.

Molecular Properties

Compound Namelithium;hydride;2-hydroxyethanesulfonic acid
PubChem CID173041120
Molecular FormulaC2H7LiO4S
Molecular Weight134.08 g/mol
Exact Mass134.02
IUPAC Namelithium;hydride;2-hydroxyethanesulfonic acid
SMILESO=S(=O)(O)CCO.[H-].[Li+]
InChIInChI=1S/C2H6O4S.Li.H/c3-1-2-7(4,5)6;;/h3H,1-2H2,(H,4,5,6);;/q;+1;-1
InChIKeyROEVZUVCGZRAHU-UHFFFAOYSA-N
XLogP-4.02
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.08
LogP ≤ 5-4.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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2-hydroxyethanesulfonic acid;isocyanic acid
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calcium;ethane-1,2-disulfonic acid;hydride
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CID 175797293
ethane-1,2-disulfonic acid;methane
CID 161397392
3,5-dihydroxypentane-1-sulfonic acid
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18-hydroxyoctadecane-1-sulfonic acid
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Frequently Asked Questions

What is the IUPAC name of lithium;hydride;2-hydroxyethanesulfonic acid?
The IUPAC name of lithium;hydride;2-hydroxyethanesulfonic acid (CID 173041120) is lithium;hydride;2-hydroxyethanesulfonic acid.
What is the SMILES notation for lithium;hydride;2-hydroxyethanesulfonic acid?
The canonical SMILES for lithium;hydride;2-hydroxyethanesulfonic acid is O=S(=O)(O)CCO.[H-].[Li+].
What is the InChIKey of lithium;hydride;2-hydroxyethanesulfonic acid?
The InChIKey is ROEVZUVCGZRAHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O4S.Li.H/c3-1-2-7(4,5)6;;/h3H,1-2H2,(H,4,5,6);;/q;+1;-1.
What are the key properties of lithium;hydride;2-hydroxyethanesulfonic acid?
lithium;hydride;2-hydroxyethanesulfonic acid has a molecular weight of 134.08 g/mol, XLogP of -4.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;2-hydroxyethanesulfonic acid is sourced from PubChem (CID 173041120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).