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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

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

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:26:55 GMT 2023
Edited
by admin
on Sat Dec 16 09:26:55 GMT 2023
Record UNII
0R1CK7MZUA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(TRIFLUOROMETHYL)BENZOIC ACID
Systematic 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
NSC-88326
Code English
Classification Tree Code System Code
EPA PESTICIDE CODE 690110
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
Code System Code Type Description
FDA UNII
0R1CK7MZUA
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-093-9
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID90870537
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
NSC
88326
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
PUBCHEM
9899
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
CAS
433-97-6
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY
CHEBI
60694
Created by admin on Sat Dec 16 09:26:55 GMT 2023 , Edited by admin on Sat Dec 16 09:26:55 GMT 2023
PRIMARY