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Details

Stereochemistry ACHIRAL
Molecular Formula C8H11NO3S
Molecular Weight 201.243
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of o-Toluidinomethanesulfonic acid

SMILES

CC1=CC=CC=C1NCS(O)(=O)=O

InChI

InChIKey=HFFSVWNRHLTGLV-UHFFFAOYSA-N
InChI=1S/C8H11NO3S/c1-7-4-2-3-5-8(7)9-6-13(10,11)12/h2-5,9H,6H2,1H3,(H,10,11,12)

HIDE SMILES / InChI

Molecular Formula C8H11NO3S
Molecular Weight 201.243
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:22:26 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:26 GMT 2023
Record UNII
9U9F2G2ZPZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
o-Toluidinomethanesulfonic acid
Systematic Name English
Methanesulfonic acid, o-toluidino-
Systematic Name English
Methanesulphonic acid, o-toluidino-
Systematic Name English
Methanesulphonic acid, ((2-methylphenyl)amino)-
Systematic Name English
Methanesulfonic acid, ((2-methylphenyl)amino)-
Systematic Name English
NSC-11212
Code English
o-Toluidinomethanesulphonic acid
Systematic Name English
Methanesulphonic acid, 1-((2-methylphenyl)amino)-
Systematic Name English
Methanesulfonic acid, 1-((2-methylphenyl)amino)-
Systematic Name English
Code System Code Type Description
CAS
94-57-5
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
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NSC
11212
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
PRIMARY
FDA UNII
9U9F2G2ZPZ
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID1059105
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-343-3
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
PRIMARY
PUBCHEM
66753
Created by admin on Sat Dec 16 12:22:26 GMT 2023 , Edited by admin on Sat Dec 16 12:22:26 GMT 2023
PRIMARY