cesium;hydride;prop-2-ene-1-sulfonic acid

C3H7CsO3S — CID 173073935

IUPACcesium;hydride;prop-2-ene-1-sulfonic acid
SMILESC=CCS(=O)(=O)O.[Cs+].[H-]
InChIInChI=1S/C3H6O3S.Cs.H/c1-2-3-7(4,5)6;;/h2H,1,3H2,(H,4,5,6);;/q;+1;-1
InChIKeySRSFEUVXZOLEPP-UHFFFAOYSA-N
MW256.06 g/mol
LogP-2.82
Rot. Bonds2

About cesium;hydride;prop-2-ene-1-sulfonic acid

cesium;hydride;prop-2-ene-1-sulfonic acid (PubChem CID 173073935) has the molecular formula C3H7CsO3S and a molecular weight of 256.06 g/mol. Its IUPAC name is cesium;hydride;prop-2-ene-1-sulfonic acid.

Molecular Properties

Compound Namecesium;hydride;prop-2-ene-1-sulfonic acid
PubChem CID173073935
Molecular FormulaC3H7CsO3S
Molecular Weight256.06 g/mol
Exact Mass255.92
IUPAC Namecesium;hydride;prop-2-ene-1-sulfonic acid
SMILESC=CCS(=O)(=O)O.[Cs+].[H-]
InChIInChI=1S/C3H6O3S.Cs.H/c1-2-3-7(4,5)6;;/h2H,1,3H2,(H,4,5,6);;/q;+1;-1
InChIKeySRSFEUVXZOLEPP-UHFFFAOYSA-N
XLogP-2.82
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.06
LogP ≤ 5-2.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 155045725
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Frequently Asked Questions

What is the IUPAC name of cesium;hydride;prop-2-ene-1-sulfonic acid?
The IUPAC name of cesium;hydride;prop-2-ene-1-sulfonic acid (CID 173073935) is cesium;hydride;prop-2-ene-1-sulfonic acid.
What is the SMILES notation for cesium;hydride;prop-2-ene-1-sulfonic acid?
The canonical SMILES for cesium;hydride;prop-2-ene-1-sulfonic acid is C=CCS(=O)(=O)O.[Cs+].[H-].
What is the InChIKey of cesium;hydride;prop-2-ene-1-sulfonic acid?
The InChIKey is SRSFEUVXZOLEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3S.Cs.H/c1-2-3-7(4,5)6;;/h2H,1,3H2,(H,4,5,6);;/q;+1;-1.
What are the key properties of cesium;hydride;prop-2-ene-1-sulfonic acid?
cesium;hydride;prop-2-ene-1-sulfonic acid has a molecular weight of 256.06 g/mol, XLogP of -2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cesium;hydride;prop-2-ene-1-sulfonic acid is sourced from PubChem (CID 173073935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).