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Details

Stereochemistry RACEMIC
Molecular Formula C11H8F6O2
Molecular Weight 286.1704
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[3,5-Bis(trifluoromethyl)phenyl]propanoic acid

SMILES

CC(C(O)=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChIKey=SFSCZXRNLPFPTP-UHFFFAOYSA-N
InChI=1S/C11H8F6O2/c1-5(9(18)19)6-2-7(10(12,13)14)4-8(3-6)11(15,16)17/h2-5H,1H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C11H8F6O2
Molecular Weight 286.1704
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:42:49 GMT 2025
Edited
by admin
on Wed Apr 02 18:42:49 GMT 2025
Record UNII
FKA77PJN8Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[3,5-Bis(trifluoromethyl)phenyl]propanoic acid
Systematic Name English
?-Methyl-3,5-bis(trifluoromethyl)benzeneacetic acid
Preferred Name English
Code System Code Type Description
PUBCHEM
11522058
Created by admin on Wed Apr 02 18:42:49 GMT 2025 , Edited by admin on Wed Apr 02 18:42:49 GMT 2025
PRIMARY
CAS
289686-73-3
Created by admin on Wed Apr 02 18:42:49 GMT 2025 , Edited by admin on Wed Apr 02 18:42:49 GMT 2025
PRIMARY
FDA UNII
FKA77PJN8Q
Created by admin on Wed Apr 02 18:42:49 GMT 2025 , Edited by admin on Wed Apr 02 18:42:49 GMT 2025
PRIMARY