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Details

Stereochemistry ACHIRAL
Molecular Formula C8H5F3O2
Molecular Weight 190.1193
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3,6-Trifluorophenylacetic acid

SMILES

OC(=O)CC1=C(F)C(F)=CC=C1F

InChI

InChIKey=QRAZASHLGLHKEB-UHFFFAOYSA-N
InChI=1S/C8H5F3O2/c9-5-1-2-6(10)8(11)4(5)3-7(12)13/h1-2H,3H2,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C8H5F3O2
Molecular Weight 190.1193
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 Wed Apr 02 20:28:42 GMT 2025
Edited
by admin
on Wed Apr 02 20:28:42 GMT 2025
Record UNII
CHL5XN3M7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3,6-Trifluorobenzeneacetic acid
Preferred Name English
2,3,6-Trifluorophenylacetic acid
Systematic Name English
Benzeneacetic acid, 2,3,6-trifluoro-
Systematic Name English
2-(2,3,6-Trifluorophenyl)acetic acid
Systematic Name English
Code System Code Type Description
CAS
114152-23-7
Created by admin on Wed Apr 02 20:28:42 GMT 2025 , Edited by admin on Wed Apr 02 20:28:42 GMT 2025
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PUBCHEM
2777948
Created by admin on Wed Apr 02 20:28:42 GMT 2025 , Edited by admin on Wed Apr 02 20:28:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID90380722
Created by admin on Wed Apr 02 20:28:42 GMT 2025 , Edited by admin on Wed Apr 02 20:28:42 GMT 2025
PRIMARY
FDA UNII
CHL5XN3M7Z
Created by admin on Wed Apr 02 20:28:42 GMT 2025 , Edited by admin on Wed Apr 02 20:28:42 GMT 2025
PRIMARY