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Details

Stereochemistry ACHIRAL
Molecular Formula C13H8F3NO4S
Molecular Weight 331.267
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Nitro-1-(phenylsulfonyl)-4-(trifluoromethyl)benzene

SMILES

[O-][N+](=O)C1=C(C=CC(=C1)C(F)(F)F)S(=O)(=O)C2=CC=CC=C2

InChI

InChIKey=KERXJRVFGPTLCU-UHFFFAOYSA-N
InChI=1S/C13H8F3NO4S/c14-13(15,16)9-6-7-12(11(8-9)17(18)19)22(20,21)10-4-2-1-3-5-10/h1-8H

HIDE SMILES / InChI

Molecular Formula C13H8F3NO4S
Molecular Weight 331.267
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 12:55:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:55:22 GMT 2023
Record UNII
L2AZ54RG7J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Nitro-1-(phenylsulfonyl)-4-(trifluoromethyl)benzene
Systematic Name English
Hydroxy(2-(phenylsulfonyl)-5-(trifluoromethyl)phenyl)azane oxide
Systematic Name English
NSC-39132
Code English
Benzene, 2-nitro-1-(phenylsulfonyl)-4-(trifluoromethyl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80182232
Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023
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PUBCHEM
236551
Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023
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CAS
2795-60-0
Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023
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FDA UNII
L2AZ54RG7J
Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023
PRIMARY
NSC
39132
Created by admin on Sat Dec 16 12:55:22 GMT 2023 , Edited by admin on Sat Dec 16 12:55:22 GMT 2023
PRIMARY