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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H7F3O
Molecular Weight 188.1465
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[4-(Trifluoromethyl)phenyl]ethanone

SMILES

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

InChI

InChIKey=HHAISVSEJFEWBZ-UHFFFAOYSA-N
InChI=1S/C9H7F3O/c1-6(13)7-2-4-8(5-3-7)9(10,11)12/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C9H7F3O
Molecular Weight 188.1465
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 13:12:21 GMT 2023
Edited
by admin
on Sat Dec 16 13:12:21 GMT 2023
Record UNII
TZ2PGR8637
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[4-(Trifluoromethyl)phenyl]ethanone
Systematic Name English
Ethanone, 1-[4-(trifluoromethyl)phenyl]-
Systematic Name English
1-(4-(Trifluoromethyl)phenyl)ethan-1-one
Systematic Name English
NSC-88346
Code English
Code System Code Type Description
FDA UNII
TZ2PGR8637
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID80221130
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY
PUBCHEM
69731
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY
CAS
709-63-7
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY
NSC
88346
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
211-913-0
Created by admin on Sat Dec 16 13:12:21 GMT 2023 , Edited by admin on Sat Dec 16 13:12:21 GMT 2023
PRIMARY