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Details

Stereochemistry ACHIRAL
Molecular Formula C6H5NO2S
Molecular Weight 155.174
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of o-Nitrothiophenol

SMILES

[O-][N+](=O)C1=CC=CC=C1S

InChI

InChIKey=JKIFPWHZEZQCQA-UHFFFAOYSA-N
InChI=1S/C6H5NO2S/c8-7(9)5-3-1-2-4-6(5)10/h1-4,10H

HIDE SMILES / InChI

Molecular Formula C6H5NO2S
Molecular Weight 155.174
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 Tue Apr 01 19:15:26 GMT 2025
Edited
by admin
on Tue Apr 01 19:15:26 GMT 2025
Record UNII
87LAB89EM2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
o-Nitrothiophenol
Systematic Name English
2-Nitrobenzene-1-thiol
Preferred Name English
o-Mercaptonitrobenzene
Systematic Name English
2-Nitrothiophenol
Systematic Name English
2-Nitrobenzenethiol
Systematic Name English
Benzenethiol, 2-nitro-
Systematic Name English
o-Nitrobenzenethiol
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60197602
Created by admin on Tue Apr 01 19:15:26 GMT 2025 , Edited by admin on Tue Apr 01 19:15:26 GMT 2025
PRIMARY
CAS
4875-10-9
Created by admin on Tue Apr 01 19:15:26 GMT 2025 , Edited by admin on Tue Apr 01 19:15:26 GMT 2025
PRIMARY
ECHA (EC/EINECS)
225-483-7
Created by admin on Tue Apr 01 19:15:26 GMT 2025 , Edited by admin on Tue Apr 01 19:15:26 GMT 2025
PRIMARY
PUBCHEM
21002
Created by admin on Tue Apr 01 19:15:26 GMT 2025 , Edited by admin on Tue Apr 01 19:15:26 GMT 2025
PRIMARY
FDA UNII
87LAB89EM2
Created by admin on Tue Apr 01 19:15:26 GMT 2025 , Edited by admin on Tue Apr 01 19:15:26 GMT 2025
PRIMARY