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Details

Stereochemistry ACHIRAL
Molecular Formula C6H6O2S
Molecular Weight 142.176
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZENESULFINIC ACID

SMILES

OS(=O)C1=CC=CC=C1

InChI

InChIKey=JEHKKBHWRAXMCH-UHFFFAOYSA-N
InChI=1S/C6H6O2S/c7-9(8)6-4-2-1-3-5-6/h1-5H,(H,7,8)

HIDE SMILES / InChI

Molecular Formula C6H6O2S
Molecular Weight 142.176
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.
1997 Dec 5
Interfacial study of benzenesulfinate chemisorbed on silver.
2001 Jan
Structure-activity relationships in platelet-activating factor (PAF). 11-From PAF-antagonism to phospholipase A(2) inhibition: syntheses and structure-activity relationships in 1-arylsulfamido-2-alkylpiperazines.
2001 Oct
1-Benzenesulfinyl piperidine/trifluoromethanesulfonic anhydride: a potent combination of shelf-stable reagents for the low-temperature conversion of thioglycosides to glycosyl triflates and for the formation of diverse glycosidic linkages.
2001 Sep 19
Hydroxylated pyrrolidines. Enantiospecific synthesis of all-cis 2,3,4,5-substituted pyrrolidine derivatives from serine.
2002 Feb 22
Allylation of exocyclic N-Acyliminium ions generated from chiral N-[1-(phenylsulfonyl)alkyl]oxazolidin-2-ones.
2002 May 3
Solid-phase synthesis of imidazo[1,2-a]pyridine using sodium benzenesulfinate as a traceless linker.
2002 Oct 31
Solid-phase synthesis of pyrazolines and isoxazolines with sodium benzenesulfinate as a traceless linker.
2003 Apr 3
[3-(1H-imidazol-4-yl)propyl]guanidines containing furoxan moieties: a new class of H3-antagonists endowed with NO-donor properties.
2003 Apr 3
"Substituent on benzenesulfonyl group" effect in use of 8-benzenesulfonamidoquinoline derivatives as chelate extractant.
2003 Feb
tert-Butyl (phenylsulfonyl)alkyl-N-hydroxycarbamates: the first class of N-(Boc) nitrone equivalents.
2005 Nov 10
Ab initio and DFT study of the geometric structures and static dipole (hyper)polarizabilities of aromatic anions.
2005 Nov 17
Stereocontrolled synthesis of the D- and L-glycero-beta-D-manno-heptopyranosides and their 6-deoxy analogues. Synthesis of methyl alpha-l-rhamno-pyranosyl-(1-->3)-D-glycero-beta-D-manno-heptopyranosyl- (1-->3)-6-deoxy-glycero-beta-D-manno-heptopyranosyl-(1-->4)-alpha-L- rhamno-pyranoside, a tetrasaccharide subunit of the lipopolysaccharide from Plesimonas shigelloides.
2006 Jun 21
S,O-acetals as novel "chiral aldehyde" equivalents.
2006 Mar 1
Revisiting benzenesulfonyl linker for the deoxygenation and multifunctionalization of phenols.
2006 May-Jun
Tandem Michael addition/amino-nitrile cyclization from 2-formyl-1,4-DHP in the synthesis of novel dihydroindolizine-based compounds.
2006 Nov 24
(1R,4R,7S)-1,7-Dimethyl-7-(phenyl-sulfonyl-meth-yl)spiro-[bicyclo-[2.2.1]heptane-2,2'-1,3-dioxolane].
2007 Dec 6
Analgesic agents without gastric damage: design and synthesis of structurally simple benzenesulfonanilide-type cyclooxygenase-1-selective inhibitors.
2007 Jan 15
Further studies on the binding of N1-substituted tryptamines at h5-HT6 receptors.
2007 Mar 15
2-Acetyl-3-methyl-pyrazine phenyl-sulfonyl-hydrazone.
2008 Apr 10
4-(Diethyl-amino)salicylaldehyde phenyl-sulfonyl-hydrazone.
2008 Apr 18
N'-[1-(2-Hydroxy-phen-yl)ethyl-idene]benzene-sulfonohydrazide.
2008 Apr 26
Correlation of the rates of solvolysis of two arenesulfonyl chlorides and of trans-beta-styrenesulfonyl chloride - precursors in the development of new pharmaceuticals.
2008 Dec
N'-(3-Ethoxy-2-hydroxybenzylidene)-benzenesulfonohydrazide.
2008 Mar 29
Reaction of the 4'-benzenesulfonyl derivatives of thymidine with organosilicon and organoaluminum reagents.
2009
Synthesis, reactivity, and kinetics of substitution in W3PdSe4 cuboidal clusters. A reexamination of the kinetics of substitution of the related W3S4 cluster with thiocyanate.
2009 Apr 20
New targets for the treatment of follicular lymphoma.
2009 Dec 23
Novel furanylarylene arylsulfonylindolesulfonamides: synthesis and their antibacterial evaluation.
2009 Jun
Corrrelation of the specific rates of solvolysis of ethyl fluoroformate using the extended Grunwald-Winstein equation.
2009 Mar
Benzhydryl phenyl sulfone.
2009 Nov 28
4,4'-Bis(dimethyl-amino)benzhydryl phenyl sulfone.
2009 Nov 7
Extracellular and intracellular polyphenol oxidases cause opposite effects on sensitivity of Streptomyces to phenolics: a case of double-edged sword.
2009 Oct 14
Synthesis, antimalarial evaluation and molecular modeling studies of hydroxyethylpiperazines, potential aspartyl protease inhibitors, part 2.
2009 Sep
Versatile synthesis and rational design of caged morpholinos.
2009 Sep 23
The differential expression of aqueous soluble proteins in breast normal and cancerous tissues in relation to stage and grade of patients.
2010
Nucleophilicity and nucleofugality of phenylsulfinate (PhSO(2)(-)): a key to understanding its ambident reactivity.
2010 Apr 7
SOD1 Is Essential for the Viability of DT40 Cells and Nuclear SOD1 Functions as a Guardian of Genomic DNA.
2010 Aug 5
Design and synthesis of a fluorescent probe for Zn2+, 5,7-bis(N,N-dimethylaminosulfonyl)-8-hydroxyquinoline-pendant 1,4,7,10-tetraazacyclododecane and Zn2+-dependent hydrolytic and Zn2+-independent photochemical reactivation of its benzenesulfonyl-caged derivative.
2010 Feb 1
Solid-phase synthesis and chemical properties of 2-(2-amino/hydroxyethyl)-1-aryl-3,4-dihydropyrazino[1, 2-b]indazol-2-iums.
2010 Jan-Feb
Stereoselective synthesis and antiviral activity of (1E,2Z,3E)-1-(piperidin-1-yl)-1-(arylhydrazono)-2-[(benzoyl/benzothiazol-2-oyl)hydrazono]-4-(aryl(1))but-3-enes.
2010 Mar
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:04:11 GMT 2023
Edited
by admin
on Sat Dec 16 09:04:11 GMT 2023
Record UNII
G9560D97PI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZENESULFINIC ACID
Systematic Name English
SAM-760 METABOLITE 1
Common Name English
PHENYLSULFINIC ACID
Systematic Name English
BENZENESULPHINIC ACID
Systematic Name English
NSC-227915
Code English
BENZENESULPHENIC ACID
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Phenylsulfinic acid
Created by admin on Sat Dec 16 09:04:12 GMT 2023 , Edited by admin on Sat Dec 16 09:04:12 GMT 2023
PRIMARY
NSC
227915
Created by admin on Sat Dec 16 09:04:12 GMT 2023 , Edited by admin on Sat Dec 16 09:04:12 GMT 2023
PRIMARY
PUBCHEM
12057
Created by admin on Sat Dec 16 09:04:12 GMT 2023 , Edited by admin on Sat Dec 16 09:04:12 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-548-4
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
CHEBI
32404
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID90210797
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
FDA UNII
G9560D97PI
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
DRUG BANK
DB03848
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
CAS
618-41-7
Created by admin on Sat Dec 16 09:04:11 GMT 2023 , Edited by admin on Sat Dec 16 09:04:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE INACTIVE