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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-(TRIFLUOROMETHYL)BENZOIC ACID

SMILES

OC(=O)C1=CC=CC=C1C(F)(F)F

InChI

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

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Detection of lung, breast, colorectal, and prostate cancers from exhaled breath using a single array of nanosensors.
2010-08-10
Patents
Name Type Language
2-(TRIFLUOROMETHYL)BENZOIC ACID
Systematic Name English
NSC-88326
Preferred Name English
BENZOIC ACID, 2-(TRIFLUOROMETHYL)-
Common Name English
O-TOLUIC ACID, .ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-
Systematic Name English
.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-O-TOLUIC ACID
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 690110
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
Code System Code Type Description
FDA UNII
0R1CK7MZUA
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
ECHA (EC/EINECS)
207-093-9
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID90870537
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
NSC
88326
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
PUBCHEM
9899
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
CAS
433-97-6
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY
CHEBI
60694
Created by admin on Mon Mar 31 22:40:10 GMT 2025 , Edited by admin on Mon Mar 31 22:40:10 GMT 2025
PRIMARY