U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H8F6O4
Molecular Weight 318.1692
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-BIS(2,2,2-TRIFLUOROETHOXY)BENZOIC ACID

SMILES

OC(=O)C1=CC(OCC(F)(F)F)=CC=C1OCC(F)(F)F

InChI

InChIKey=YPGYLCZBZKRYQJ-UHFFFAOYSA-N
InChI=1S/C11H8F6O4/c12-10(13,14)4-20-6-1-2-8(7(3-6)9(18)19)21-5-11(15,16)17/h1-3H,4-5H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C11H8F6O4
Molecular Weight 318.1692
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 Sat Dec 16 18:20:53 GMT 2023
Edited
by admin
on Sat Dec 16 18:20:53 GMT 2023
Record UNII
ID4JP01L3W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-BIS(2,2,2-TRIFLUOROETHOXY)BENZOIC ACID
Systematic Name English
FLECAINIDE ACID
Common Name English
FLECAINIDE ACID [USP IMPURITY]
Common Name English
FLECAINIDE ACETATE IMPURITY D [EP IMPURITY]
Common Name English
BENZOIC ACID, 2,5-BIS(2,2,2-TRIFLUOROETHOXY)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50371111
Created by admin on Sat Dec 16 18:20:54 GMT 2023 , Edited by admin on Sat Dec 16 18:20:54 GMT 2023
PRIMARY
CAS
35480-52-5
Created by admin on Sat Dec 16 18:20:54 GMT 2023 , Edited by admin on Sat Dec 16 18:20:54 GMT 2023
PRIMARY
PUBCHEM
2736078
Created by admin on Sat Dec 16 18:20:54 GMT 2023 , Edited by admin on Sat Dec 16 18:20:54 GMT 2023
PRIMARY
FDA UNII
ID4JP01L3W
Created by admin on Sat Dec 16 18:20:54 GMT 2023 , Edited by admin on Sat Dec 16 18:20:54 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP