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Isethionic acid

CAT: 1459-CS-BP-00013Size: 1 EachDry Ice: NoHazardous: No
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Description
Isethionic acid is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. The product is supplied by Clearsynth under CAT No. CS-BP-00013. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1561-99-5
Synonyms
Isethionic acid
Molecular Formula
C 2 H 5 KO 4 S
Molecular Weight
164.22
Additionnal Information
Isethionic acid is supplied with detailed characterization data compliant with regulatory guideline. Isethionic acid can be used for analytical method development, method validation (AMV), Quality Control (QC), ANDA-related analytical work, and commercial pharmaceutical research applications.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Ethanesulfonic acid, 2-hydroxy-, potassium salt (1:1)

See also: Isethionic Acid (annotation moved to); Sodium Isethionate (annotation moved to); Isethionate (annotation moved to).

CAS Number1561-99-5
PubChem CID23689117
IUPAC Namepotassium 2-hydroxyethanesulfonate
Molecular FormulaC2H5KO4S
Molecular Weight164.22
Topological Polar Surface Area85.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity121
SMILES
C(CS(=O)(=O)[O-])O.[K+]
InChI
InChI=1S/C2H6O4S.K/c3-1-2-7(4,5)6;/h3H,1-2H2,(H,4,5,6);/q;+1/p-1
InChIKey
DMNPUBKRNRRYMC-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Ethanesulfonic acid, 2-hydroxy-, potassium salt (1:1)
CAS: 1561-99-5
CID: 23689117
Formula: C2H5KO4S
MW: 164.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight164.22
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass163.95456129
Monoisotopic Mass163.95456129
Topological Polar Surface Area85.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity121
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T20854Isethionic acid
GK0622-1kgIsethionic acid sodium salt
sc-250172Isethionic acid ammonium salt
abx186019-01Isethionic acid (80% in water)
52934744-5gIsethionic acid solution 80% in water
HY-Y0095RIsethionic acid (80% in water) (Standard)
HY-Y1173RIsethionic acid sodium salt (Standard)

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