potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid

C6H11KO3S — CID 173007165

IUPACpotassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid
SMILESC=CCC1(S(=O)(=O)O)CC1.[H-].[K+]
InChIInChI=1S/C6H10O3S.K.H/c1-2-3-6(4-5-6)10(7,8)9;;/h2H,1,3-5H2,(H,7,8,9);;/q;+1;-1
InChIKeyJJABBBKRUDHGAG-UHFFFAOYSA-N
MW202.32 g/mol
LogP-1.90
Rot. Bonds3

About potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid

potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid (PubChem CID 173007165) has the molecular formula C6H11KO3S and a molecular weight of 202.32 g/mol. Its IUPAC name is potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid.

Molecular Properties

Compound Namepotassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid
PubChem CID173007165
Molecular FormulaC6H11KO3S
Molecular Weight202.32 g/mol
Exact Mass202.01
IUPAC Namepotassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid
SMILESC=CCC1(S(=O)(=O)O)CC1.[H-].[K+]
InChIInChI=1S/C6H10O3S.K.H/c1-2-3-6(4-5-6)10(7,8)9;;/h2H,1,3-5H2,(H,7,8,9);;/q;+1;-1
InChIKeyJJABBBKRUDHGAG-UHFFFAOYSA-N
XLogP-1.90
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 5-1.90
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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Frequently Asked Questions

What is the IUPAC name of potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid?
The IUPAC name of potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid (CID 173007165) is potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid.
What is the SMILES notation for potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid?
The canonical SMILES for potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid is C=CCC1(S(=O)(=O)O)CC1.[H-].[K+].
What is the InChIKey of potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid?
The InChIKey is JJABBBKRUDHGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O3S.K.H/c1-2-3-6(4-5-6)10(7,8)9;;/h2H,1,3-5H2,(H,7,8,9);;/q;+1;-1.
What are the key properties of potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid?
potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid has a molecular weight of 202.32 g/mol, XLogP of -1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;1-prop-2-enylcyclopropane-1-sulfonic acid is sourced from PubChem (CID 173007165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).