DHBS - ≥99%, used for Used in conjunction with 4-aminoantipyrine (4-AAP) and hydrogen peroxide (H2O2) for chromogenic quantitation of peroxidase in coupled enzymatic reactions. Component of Trinder reagent for use with peroxidase to measure generation of

CAS: 54970-72-8 Cat. No.: D109083 Formula: C₆H₃O₄SCl₂Na Molecular Weight: 265.05 Beilstein Registry Number: 3640643 EC Number: 259-416-8

GRADE & PURITY ≥99%

Synonyms

Sodium 3,5-dichloro-2-hydroxybenzenesulfonate | 3,5-dichloro-2-hydroxybenzenesulfonic acid, sodium salt | 2,4-Dichlorophenol-6-sulfonic Acid Sodium Salt | 3,5-Dichloro-2-hydroxybenzenesulfonic Acid Sodium Salt | DCHBS

Storage

Room temperature

Shipped In

Normal

Overview

Sodium 3,5-dichloro-2-hydroxybenzenesulfonate is used in conjunction with 4-aminoantipyrine (4-AAP) and hydrogen peroxide (H2O2) for chromogenic quantitation of uric acid in serum and urine samples.

Specifications

Synonyms

Sodium 3,5-dichloro-2-hydroxybenzenesulfonate | 3,5-dichloro-2-hydroxybenzenesulfonic acid, sodium salt | 2,4-Dichlorophenol-6-sulfonic Acid Sodium Salt | 3,5-Dichloro-2-hydroxybenzenesulfonic Acid Sodium Salt | DCHBS

Specifications & Purity

≥99%

Application

Used in conjunction with 4-aminoantipyrine (4-AAP) and hydrogen peroxide (H2O2) for chromogenic quantitation of peroxidase in coupled enzymatic reactions. Component of Trinder reagent for use with peroxidase to measure generation of hydrogen peroxide in a

Storage

Room temperature

Shipped In

Normal

Purity

≥99%

Names and Identifiers

Pubchem Sid

504762450

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504762450

Canonical Smiles

C1=C(C=C(C(=C1S(=O)(=O)[O-])O)Cl)Cl.[Na+]

IUPAC Name

sodium;3,5-dichloro-2-hydroxybenzenesulfonate

InChIKey

NMWCVZCSJHJYFW-UHFFFAOYSA-M

INCHI

1S/C6H4Cl2O4S.Na/c7-3-1-4(8)6(9)5(2-3)13(10,11)12;/h1-2,9H,(H,10,11,12);/q;+1/p-1

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)[O-])O)Cl)Cl.[Na+]

WGK Germany

3

Molecular Weight

265.05

Beilstein

3640643

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzenesulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzenesulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonic acids and derivatives
• Alternative Parents: Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds P-chlorophenols O-chlorophenols Dichlorobenzenes Aryl chlorides Sulfonyls Organosulfonic acids Organic metal halides Organooxygen compounds Organochlorides Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - 1,3-dichlorobenzene - 4-halophenol - 2-halophenol - 2-chlorophenol - 4-chlorophenol - Chlorobenzene - Halobenzene - Phenol - Aryl halide - Aryl chloride - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Organic metal halide - Organic alkali metal salt - Organic salt - Organic sodium salt - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: H2O: 50 mg/mL
• Sensitivity: Hygroscopic
• Melt Point(°C): >300℃
• Molecular Weight: 265.050 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 263.903 Da
• Monoisotopic Mass: 263.903 Da
• Topological Polar Surface Area: 85.800 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 278.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3