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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5F3N2O2
Molecular Weight 206.122
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Nitro-4-(trifluoromethyl)aniline

SMILES

NC1=C(C=C(C=C1)C(F)(F)F)[N+]([O-])=O

InChI

InChIKey=ATXBGHLILIABGX-UHFFFAOYSA-N
InChI=1S/C7H5F3N2O2/c8-7(9,10)4-1-2-5(11)6(3-4)12(13)14/h1-3H,11H2

HIDE SMILES / InChI

Molecular Formula C7H5F3N2O2
Molecular Weight 206.122
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 12:01:58 GMT 2023
Edited
by admin
on Sat Dec 16 12:01:58 GMT 2023
Record UNII
JCH7KWT394
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Nitro-4-(trifluoromethyl)aniline
Systematic Name English
4-(Trifluoromethyl)-2-nitroaniline
Systematic Name English
NSC-13396
Code English
NSC-9429
Code English
Benzenamine, 2-nitro-4-(trifluoromethyl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID6074912
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
NSC
9429
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
PUBCHEM
67865
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
NSC
13396
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
CAS
400-98-6
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
FDA UNII
JCH7KWT394
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
206-926-3
Created by admin on Sat Dec 16 12:01:58 GMT 2023 , Edited by admin on Sat Dec 16 12:01:58 GMT 2023
PRIMARY