sodium;hydride;2-hydroxyacetic acid;sulfuric acid

C2H7NaO7S — CID 173434097

IUPACsodium;hydride;2-hydroxyacetic acid;sulfuric acid
SMILESO=C(O)CO.O=S(=O)(O)O.[H-].[Na+]
InChIInChI=1S/C2H4O3.Na.H2O4S.H/c3-1-2(4)5;;1-5(2,3)4;/h3H,1H2,(H,4,5);;(H2,1,2,3,4);/q;+1;;-1
InChIKeyVLPQLLXRNTUDJX-UHFFFAOYSA-N
MW198.13 g/mol
LogP-4.47
Rot. Bonds1

About sodium;hydride;2-hydroxyacetic acid;sulfuric acid

sodium;hydride;2-hydroxyacetic acid;sulfuric acid (PubChem CID 173434097) has the molecular formula C2H7NaO7S and a molecular weight of 198.13 g/mol. Its IUPAC name is sodium;hydride;2-hydroxyacetic acid;sulfuric acid.

Molecular Properties

Compound Namesodium;hydride;2-hydroxyacetic acid;sulfuric acid
PubChem CID173434097
Molecular FormulaC2H7NaO7S
Molecular Weight198.13 g/mol
Exact Mass197.98
IUPAC Namesodium;hydride;2-hydroxyacetic acid;sulfuric acid
SMILESO=C(O)CO.O=S(=O)(O)O.[H-].[Na+]
InChIInChI=1S/C2H4O3.Na.H2O4S.H/c3-1-2(4)5;;1-5(2,3)4;/h3H,1H2,(H,4,5);;(H2,1,2,3,4);/q;+1;;-1
InChIKeyVLPQLLXRNTUDJX-UHFFFAOYSA-N
XLogP-4.47
TPSA132.13 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.13
LogP ≤ 5-4.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;hydride;2-hydroxyacetic acid;sulfuric acid?
The IUPAC name of sodium;hydride;2-hydroxyacetic acid;sulfuric acid (CID 173434097) is sodium;hydride;2-hydroxyacetic acid;sulfuric acid.
What is the SMILES notation for sodium;hydride;2-hydroxyacetic acid;sulfuric acid?
The canonical SMILES for sodium;hydride;2-hydroxyacetic acid;sulfuric acid is O=C(O)CO.O=S(=O)(O)O.[H-].[Na+].
What is the InChIKey of sodium;hydride;2-hydroxyacetic acid;sulfuric acid?
The InChIKey is VLPQLLXRNTUDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O3.Na.H2O4S.H/c3-1-2(4)5;;1-5(2,3)4;/h3H,1H2,(H,4,5);;(H2,1,2,3,4);/q;+1;;-1.
What are the key properties of sodium;hydride;2-hydroxyacetic acid;sulfuric acid?
sodium;hydride;2-hydroxyacetic acid;sulfuric acid has a molecular weight of 198.13 g/mol, XLogP of -4.47, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;2-hydroxyacetic acid;sulfuric acid is sourced from PubChem (CID 173434097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).