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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H6O4S
Molecular Weight 174.174
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-PHENOLSULFONIC ACID

SMILES

OC1=CC=CC=C1S(O)(=O)=O

InChI

InChIKey=IULJSGIJJZZUMF-UHFFFAOYSA-N
InChI=1S/C6H6O4S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4,7H,(H,8,9,10)

HIDE SMILES / InChI

Molecular Formula C6H6O4S
Molecular Weight 174.174
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

2-HYDROXYBENZENESULFONIC ACID belongs to the compound’s class of phenolsulfonic acid. This class of compounds are Irritating to mucous membranes, skin, and eyes. Moderately toxic by ingestion.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
A skin sensitization safety assessment of a new bleach activator technology in detergent applications.
2002 Apr
Formation of drug-arylsulfonate complexes inside liposomes: a novel approach to improve drug retention.
2006 Jan 10
Formation of a liquid organic ion associate in aqueous solution and its application to the GF-AAS determination of trace cadmium in environmental water as a complex with 2-(5-bromo-2-pyridylazo)-5-(N-propyl-N-sulfopropylamino)phenol.
2008 Jul
Preparation of phenolic compounds by decarboxylation of hydroxybenzoic acids or desulfonation of hydroxybenzenesulfonic acid, catalysed by electron rich palladium complexes.
2009 Jun 28
Considerable change of fluorescence properties upon multiple binding of coralyne to 4-sulfonatocalixarenes.
2010 Mar 4
Patents

Sample Use Guides

deodorant ingredient
Route of Administration: Topical
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:27:00 GMT 2023
Edited
by admin
on Sat Dec 16 09:27:00 GMT 2023
Record UNII
0YY4Y390MW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-PHENOLSULFONIC ACID
Common Name English
2-HYDROXYBENZENESULFONIC ACID
Systematic Name English
BENZENESULFONIC ACID, O-HYDROXY-
Systematic Name English
O-HYDROXYBENZENESULFONIC ACID
Systematic Name English
NSC-227905
Code English
PHENOL-2-SULFONIC ACID
Common Name English
NSC-243747
Code English
2-SULFOPHENOL
Systematic Name English
Code System Code Type Description
PUBCHEM
11867
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
CHEBI
71049
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID90274036
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
SMS_ID
300000038498
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
NSC
243747
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
FDA UNII
0YY4Y390MW
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
CAS
609-46-1
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-191-4
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY
NSC
227905
Created by admin on Sat Dec 16 09:27:00 GMT 2023 , Edited by admin on Sat Dec 16 09:27:00 GMT 2023
PRIMARY