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98-11-3,MFCD00011689
Catalog No.:AA003NY8

98-11-3 | Benzenesulfonic Acid

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Purity
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5g
98%(HPLC)
in stock  
$24.00   $17.00
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25g
97%
in stock  
$54.00   $38.00
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100g
97%
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$145.00   $102.00
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003NY8
Chemical Name:
Benzenesulfonic Acid
CAS Number:
98-11-3
Molecular Formula:
C6H6O3S
Molecular Weight:
158.1750
MDL Number:
MFCD00011689
SMILES:
OS(=O)(=O)c1ccccc1
Properties
Properties
 
BP:
190 °C  
Form:
Solid  
MP:
30-60 °C  
Refractive Index:
1.5151 (estimate)  
Solubility:
H2O: soluble0.1g/10 mL, clear, colorless  
Stability:
Hygroscopic  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
184  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  

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Title: (2S,4S)-4-Fluoro-1-{[(2-hydroxy-1,1-dimethylethyl)amino]acetyl}-pyrrolidine-2-carbonitrile monobenzenesulfonate (TS-021) is a selective and reversible dipeptidyl peptidase IV inhibitor.

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Title: (E)-2-[4-(Diethyl-amino)-styr-yl]-1-methyl-pyridinium benzene-sulfonate mono-hydrate.

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Title: Photocatalytic degradation of benzenesulfonate on colloidal titanium dioxide.

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Title: 4-[1-(Substituted aryl/alkyl carbonyl)-benzoimidazol-2-yl]-benzenesulfonic acids: synthesis, antimicrobial activity, QSAR studies, and antiviral evaluation.

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Title: Reduction of 2,3,5-triphenyl-2H-tetrazolium chloride in the presence of polyelectrolytes containing 4-styrenesulfonate moieties.

Journal: The journal of physical chemistry. B 20080501

Title: Evidence of PPII-like helical conformation and glass transition in a self-assembled solid-state polypeptide-surfactant complex: poly(L-histidine)/docylbenzenesulfonic acid.

Journal: Biomacromolecules 20080501

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Title: Removal of anionic surfactants from aqueous solutions by adsorption onto high area activated carbon cloth studied by in situ UV spectroscopy.

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Title: Study of biodegradation products from azo dyes in fungal degradation by capillary electrophoresis/electrospray mass spectrometry.

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Title: Testing organic solvents for the extraction from fish of sulfophenylcarboxylic acids, prior to determination by liquid chromatography-mass spectrometry.

Journal: Analytical and bioanalytical chemistry 20070701

Title: Histopathological changes in testis of the freshwater fish, Heteropneustes fossilis (Bloch) exposed to linear alkyl benzene sulphonate (LAS).

Journal: Journal of environmental biology 20070701

Title: Detection of hypoxia-related proteins in medaka (Oryzias latipes) brain tissue by difference gel electrophoresis and de novo sequencing of 4-sulfophenyl isothiocyanate-derivatized peptides by matrix-assisted laser desorption/ionization time-of-flight mass spectrometry.

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Title: Silica-supported sodium sulfonate with ionic liquid: a neutral catalyst system for Michael reactions of indoles in water.

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Title: Lateral phase separation gives multiple lamellar phases in a 'binary' surfactant/water system: the phase behavior of sodium alkyl benzene sulfonate/water mixtures.

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Title: Peripheral infusion of rat bone marrow derived endothelial progenitor cells leads to homing in acute lung injury.

Journal: Respiratory research 20070101

Title: Impact of surface derivatization of poly-L-lysine dendrimers with anionic arylsulfonate or succinate groups on intravenous pharmacokinetics and disposition.

Journal: Molecular pharmaceutics 20070101

Title: R2(2)(8) motifs in Aminopyrimidine sulfonate/carboxylate interactions: crystal structures of pyrimethaminium benzenesulfonate monohydrate (2:2:1) and 2-amino-4,6-dimethylpyrimidinium sulfosalicylate dihydrate (4:2:2).

Journal: Chemistry Central journal 20070101

Title: Hierarchical ionic self-assembly of rod-comb block copolypeptide-surfactant complexes.

Journal: Biomacromolecules 20061201

Title: Permeation flux of organic molecules through silica-surfactant nanochannels in a porous alumina membrane.

Journal: Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20061201

Title: Inhibition of (Na(+)/K(+))-ATPase by Cibacron Blue 3G-A and its analogues.

Journal: General physiology and biophysics 20061201

Title: Inorganic asymmetric synthesis: asymmetric synthesis of a two-bladed propeller, octahedral metal complex.

Journal: Inorganic chemistry 20061016

Title: Ferromagnetic coupling promoted by kappa3N:kappa2N bridging system.

Journal: Inorganic chemistry 20060807

Title: Low level determination of p-toluenesulfonate and benzenesulfonate esters in drug substance by high performance liquid chromatography/mass spectrometry.

Journal: Journal of chromatography. A 20060630

Title: The suramin analog 4,4',4'',4'''-(carbonylbis(imino-5,1,3-benzenetriylbis (carbonylimino)))tetra-kis-benzenesulfonic acid (NF110) potently blocks P2X3 receptors: subtype selectivity is determined by location of sulfonic acid groups.

Journal: Molecular pharmacology 20060601

Title: Iron porphyrin-cyclodextrin supramolecular complex as a functional model of myoglobin in aqueous solution.

Journal: Inorganic chemistry 20060529

Title: Acid-base equilibria in 5,10,15,20-tetrakis(4-sulfonatophenyl)chlorin: Role of conformational flexibility.

Journal: The journal of physical chemistry. A 20060316

Title: Carbon-fiber microelectrodes modified with 4-sulfobenzene have increased sensitivity and selectivity for catecholamines.

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Title: Synthesis of the enediol isofurans, endogenous oxidation products of arachidonic acid.

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Title: A scalable machine-learning approach to recognize chemical names within large text databases.

Journal: BMC bioinformatics 20060101

Title: Dihydroxy-2,5 benzenesulphonate (dobesilate) elicits growth arrest and apoptosis in glioma cells.

Journal: Neurological research 20051201

Title: Ab initio and DFT study of the geometric structures and static dipole (hyper)polarizabilities of aromatic anions.

Journal: The journal of physical chemistry. A 20051117

Title: Raman spectroscopic study of hydrogen bonding in benzenesulfonic acid/acrylonitrile solutions.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20051001

Title: Determination of methyl and ethyl esters of methanesulfonic, benzenesulfonic and p-toluenesulfonic acids in active pharmaceutical ingredients by solid-phase microextraction (SPME) coupled to GC/SIM-MS.

Journal: Journal of pharmaceutical and biomedical analysis 20050915

Title: Anaerobic digestion of linear alkyl benzene sulfonates: biodegradation kinetics and metabolite analysis.

Journal: Chemosphere 20050901

Title: Hydrogen-shift isomerism: mass spectrometry of isomeric benzenesulfonate and 2-, 3- and 4-dehydrobenzenesulfonic acid anions in the gas phase.

Journal: Journal of mass spectrometry : JMS 20050801

Title: Fenton degradation of organic compounds promoted by dyes under visible irradiation.

Journal: Environmental science & technology 20050801

Title: Mucosal colonisation with Lactobacillus casei mitigates barrier injury induced by exposure to trinitronbenzene sulphonic acid.

Journal: Gut 20050701

Title: Photo-cross-linked immobilization of polyelectrolytes for enzymatic construction of conductive nanocomposites.

Journal: Journal of the American Chemical Society 20050629

Title: Sorption enhancement of aromatic sulfonates onto an aminated hyper-cross-linked polymer.

Journal: Environmental science & technology 20050501

Title: Discovery of CC chemokine receptor-3 (CCR3) antagonists with picomolar potency.

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Title: Structure-activity considerations and in vitro approaches to assess the genotoxicity of 19 methane-, benzene- and toluenesulfonic acid esters.

Journal: Mutation research 20050307

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Journal: Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20050201

Title: Linear alkyl benzene sulphonate (LAS) degradation by immobilized Pseudomonas aeruginosa under low intensity ultrasound.

Journal: Colloids and surfaces. B, Biointerfaces 20050115

Title: Photoreaction of aromatic compounds at alpha-FeOOH/H2O interface in the presence of H2O2: evidence for organic-goethite surface complex formation.

Journal: Water research 20050101

Title: Determination of biodegradation products from sulfonated dyes by Pleurotus ostreatususing capillary electrophoresis coupled with mass spectrometry.

Journal: Biotechnology letters 20050101

Title: Matrix-assisted laser desorption/ionization time-of-flight mass spectrometry of 4-sulfophenyl isothiocyanate-derivatized peptides on AnchorChip sample supports using the sodium-tolerant matrix 2,4,6-trihydroxyacetophenone and diammonium citrate.

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Title: Arylsulfonates as sole source of sulfur for Clostridium pasteurianum DSM 12136.

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Title: Preparation of natural alpha-tocopherol from non-alpha-tocopherols.

Journal: Journal of Zhejiang University. Science 20041201

Title: Silver(I) arylsulfonates: a systematic study of 'softer' hybrid inorganic-organic solids.

Journal: Inorganic chemistry 20041018

Title: New extraction method for the analysis of linear alkylbenzene sulfonates in marine organisms. Pressurized liquid extraction versus Soxhlet extraction.

Journal: Journal of chromatography. A 20041015

Title: Simultaneous extraction and fate of linear alkylbenzene sulfonates, coconut diethanol amides, nonylphenol ethoxylates and their degradation products in wastewater treatment plants, receiving coastal waters and sediments in the Catalonian area (NE Spain).

Journal: Journal of chromatography. A 20041015

Title: Nonpeptide alpha V beta 3 antagonists. Part 9: Improved pharmacokinetic profile through the use of an aliphatic, des-amide backbone.

Journal: Bioorganic & medicinal chemistry letters 20040906

Title: An in vitro evaluation of human dermal exposure to benzene sulfonate, m-benzene disulfonate and p-phenol sulfonate.

Journal: Bulletin of environmental contamination and toxicology 20040801

Title: 2,4-Bis(octadecanoylamino)benzenesulfonic acid sodium salt as a novel scavenger receptor inhibitor with low molecular weight.

Journal: Bioorganic & medicinal chemistry letters 20040607

Title: Raman spectroscopy of benzenesulfonic and 4-toluenesulfonic acids dissolved in dimethylsulfoxide.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040601

Title: Gene expression changes in peripheral blood-derived dendritic cells following exposure to a contact allergen.

Journal: Toxicology letters 20040502

Title: Stereocontrol in organic synthesis using silicon-containing compounds. Studies directed towards the synthesis of ebelactone A.

Journal: Organic & biomolecular chemistry 20040407

Title: Differentiation and quantification of linear alkyl benzenesulfonate isomers by liquid chromatography-ion-trap mass spectrometry.

Journal: Journal of chromatography. A 20040326

Title: Preparation, properties, reactions, and adenosine receptor affinities of sulfophenylxanthine nitrophenyl esters: toward the development of sulfonic acid prodrugs with peroral bioavailability.

Journal: Journal of medicinal chemistry 20040212

Title: Fate of linear alkylbenzene sulfonate (LAS) in activated sludge plants.

Journal: Water research 20040201

Title: Dermal irritation assessment of three benzene sulfonate compounds.

Journal: International journal of toxicology 20040101

Title: Anti-inflammatory action of sulfoaryl 3,3-disubstituted triazenes in rat experimental edema models.

Journal: Die Pharmazie 20031001

Title: Development of a novel granular detergent with an interspersion particle comprising an anionic surfactant and a polymeric polycarboxalate.

Journal: Chemical & pharmaceutical bulletin 20030601

Title: Influence of LAS on marine calanoid copepod population dynamics and potential reproduction.

Journal: Aquatic toxicology (Amsterdam, Netherlands) 20030529

Title: Raman and infrared spectral study of meso-sulfonatophenyl substituted porphyrins (TPPSn, n = 1, 2A, 2O, 3, 4).

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20030101

Title: Factors contributing to the incompatibility between simplified-step adhesives and chemically-cured or dual-cured composites. Part III. Effect of acidic resin monomers.

Journal: The journal of adhesive dentistry 20030101

Title: Role of CA(2+)-activated K+ channels in the regulation of basilar arterial tone in spontaneously hypertensive rats.

Journal: Clinical and experimental pharmacology & physiology 20020701

Title: Integration of aquatic fate and ecological responses to linear alkyl benzene sulfonate (LAS) in model stream ecosystems.

Journal: Ecotoxicology and environmental safety 20020601

Title: High-performance liquid chromatography with electrochemical detection applied to the analysis of 3,4-dihydroxymethamphetamine in human plasma and urine.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20020405

Title: Development of a nanofiltration process to improve the stability of a novel anti-MRSA carbapenem drug candidate.

Journal: Journal of pharmaceutical sciences 20020401

Title: Stability study and determination of benzene- and naphthalenesulfonates following an on-line solid-phase extraction method using the new programmable field extraction system.

Journal: The Analyst 20020401

Title: Effect of linear alkyl benzene sulphonate on erythrocyte sedimentation rate of teleost fish, Heteropneustes fossilis.

Journal: Journal of environmental biology 20020401

Title: Formation of metabolites during biodegradation of linear alkylbenzene sulfonate in an upflow anaerobic sludge bed reactor under thermophilic conditions.

Journal: Biotechnology and bioengineering 20020305

Title: Synthesis of (bis)sulfonic acid, (bis)benzamides as follicle-stimulating hormone (FSH) antagonists.

Journal: Bioorganic & medicinal chemistry 20020301

Title: Evaluation of the mixed aggregate method as an alternative to the bismuth active substances and cobalt thiocyanate active substances procedures for the determination of nonionic surfactants in raw and treated sewage.

Journal: Journal of AOAC International 20020101

Title: Regeneration of process water containing surfactants by nanofiltration--investigation and modelling of mass transport.

Journal: Water science and technology : a journal of the International Association on Water Pollution Research 20020101

Title: Haematotoxic effect of linear alkyl benzene sulphonate (LAS) in fish, Heteropneustes fossilis.

Journal: Journal of environmental biology 20020101

Title: Functional equality in the absence of structural similarity: an added dimension to molecular mimicry.

Journal: The Journal of biological chemistry 20011019

Title: Comparative study of the acute toxicity of anionic surfactans alkyl benzene sulphonate (ABS) and sodium dodecyl sulphate (SDS) on gilthead, Sparus aurata L., eggs.

Journal: Histology and histopathology 20011001

Title: Antibody-based methods for surfactant screening.

Journal: Fresenius' journal of analytical chemistry 20011001

Title: Impact of linear alkyl benzene sulphonate (LAS) on phosphatase activity in testis of the teleostean fish, Heteropneustes fossilis (Bloch).

Journal: Journal of environmental biology 20011001

Title: Determination of famotidine in low-volume human plasma by normal-phase liquid chromatography/tandem mass spectrometry.

Journal: Journal of mass spectrometry : JMS 20010701

Title: Morpho-histochemical changes in the liver and intestine of young giltheads (fish-nursery), Sparus aurata, L., induced by acute action of the anionic tensioactive alkylbenzene sulphonate.

Journal: European journal of histochemistry : EJH 20010101

Title: Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

Journal: Journal of medicinal chemistry 19971205

Title: 3-Sulphocatechol 2,3-dioxygenase and other dioxygenases (EC 1.13.11.2 and EC 1.14.12.-) in the degradative pathways of 2-aminobenzenesulphonic, benzenesulphonic and 4-toluenesulphonic acids in Alcaligenes sp. strain O-1.

Journal: Microbiology (Reading, England) 19940701

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Tags:98-11-3 Molecular Formula|98-11-3 MDL|98-11-3 SMILES|98-11-3 Benzenesulfonic Acid |Organic_Building_Blocks