U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7O2S.Na
Molecular Weight 178.184
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM P-TOLUENESULFINATE

SMILES

[Na+].CC1=CC=C(C=C1)S([O-])=O

InChI

InChIKey=KFZUDNZQQCWGKF-UHFFFAOYSA-M
InChI=1S/C7H8O2S.Na/c1-6-2-4-7(5-3-6)10(8)9;/h2-5H,1H3,(H,8,9);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C7H7O2S
Molecular Weight 155.194
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Microtensile bond strength of two single-step adhesive systems to bur-prepared dentin.
2001 Summer
Synthesis of substituted quinolines using the dianion addition of N-Boc-anilines and alpha-tolylsulfonyl-alpha,beta-unsaturated ketones.
2002 Dec 27
The asymmetric dialkylzinc addition to imines catalyzed by [2.2]paracyclophane-based N,O-ligands.
2002 May 29
Base-induced photocyclization of 1,2-diaryl-1-tosylethenes. A mechanistically novel approach to phenanthrenes and phenanthrenoids.
2003 Dec 25
Highly selective palladium catalyzed kinetic resolution and enantioselective substitution of racemic allylic carbonates with sulfur nucleophiles: asymmetric synthesis of allylic sulfides, allylic sulfones, and allylic alcohols.
2003 Sep 5
Unsymmetrical diaryl sulfones and aryl vinyl sulfones through palladium-catalyzed coupling of aryl and vinyl halides or triflates with sulfinic acid salts.
2004 Aug 20
Analysis of eicosapentaenoic and docosahexaenoic acid geometrical isomers formed during fish oil deodorization.
2006 Sep 29
A highly stereoselective synthesis of (-)-(ent)-julifloridine from the cyclization of an alanine-derived chloroamine with an acetylenic sulfone.
2007 May 11
Preparation, chromatographic separation and relative retention times of cis/trans heptadecaenoic (17:1) fatty acids.
2008 Dec 19
Deposition of functionalized polymer layers in surface plasmon resonance immunosensors by in-situ polymerization in the evanescent wave field.
2009 Jan 1
Development of dual-curing type experimental composite resin cement for orthodontic bonding -effect of additional amount of accelerators on the mechanical properties-.
2009 Jul
Generation of ortho-quinone methides by p-TsOH on silica and their hetero-Diels-Alder reactions with styrenes.
2009 May 15
A new resin-bonded retrograde filling material.
2009 Nov
Synthesis of the marine pyrroloiminoquinone alkaloids, discorhabdins.
2010 Apr 21
Impact of co-incorporating laminin peptide dopants and neurotrophic growth factors on conducting polymer properties.
2010 Jan
Brønsted acid catalyzed cyclization of propargylic alcohols with thioamides. Facile synthesis of di- and trisubstituted thiazoles.
2010 Sep 17
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:50:19 GMT 2023
Edited
by admin
on Fri Dec 15 15:50:19 GMT 2023
Record UNII
7CKU5W4TRM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM P-TOLUENESULFINATE
Common Name English
SODIUM 4-METHYLBENZENESULFINATE
Systematic Name English
NSC-9077
Code English
NSC-4871
Code English
SODIUM P-TOLUENE SULFINATE ANHYDROUS
Common Name English
BENZENESULFINIC ACID, 4-METHYL-, SODIUM SALT
Common Name English
SPTS
Common Name English
Code System Code Type Description
CAS
824-79-3
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID3061180
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
FDA UNII
7CKU5W4TRM
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
PUBCHEM
2723791
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
NSC
4871
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
NSC
9077
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
ECHA (EC/EINECS)
212-538-5
Created by admin on Fri Dec 15 15:50:19 GMT 2023 , Edited by admin on Fri Dec 15 15:50:19 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE