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Details

Stereochemistry ACHIRAL
Molecular Formula C7H3F4NO2
Molecular Weight 209.0978
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Fluoro-5-nitrobenzotrifluoride

SMILES

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

InChI

InChIKey=DNTHMWUMRGOJRY-UHFFFAOYSA-N
InChI=1S/C7H3F4NO2/c8-6-2-1-4(12(13)14)3-5(6)7(9,10)11/h1-3H

HIDE SMILES / InChI

Molecular Formula C7H3F4NO2
Molecular Weight 209.0978
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 19:29:02 GMT 2025
Edited
by admin
on Tue Apr 01 19:29:02 GMT 2025
Record UNII
QLT47ACG6N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Fluoro-5-nitrobenzotrifluoride
Common Name English
alpha,alpha,alpha-2-Tetrafluorotoluene
Preferred Name English
NSC-10302
Code English
Benzene, 1-fluoro-4-nitro-2-(trifluoromethyl)-
Systematic Name English
1-Fluoro-4-nitro-2-(trifluoromethyl)benzene
Systematic Name English
Code System Code Type Description
CAS
400-74-8
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID20193064
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY
PUBCHEM
94954
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY
ECHA (EC/EINECS)
206-925-8
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY
NSC
10302
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY
FDA UNII
QLT47ACG6N
Created by admin on Tue Apr 01 19:29:02 GMT 2025 , Edited by admin on Tue Apr 01 19:29:02 GMT 2025
PRIMARY