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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H9F3O
Molecular Weight 202.1731
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[2-(Trifluoromethyl)phenyl]-2-propanone

SMILES

CC(=O)CC1=C(C=CC=C1)C(F)(F)F

InChI

InChIKey=HEGSHYHOLHYKHD-UHFFFAOYSA-N
InChI=1S/C10H9F3O/c1-7(14)6-8-4-2-3-5-9(8)10(11,12)13/h2-5H,6H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
1-[2-(Trifluoromethyl)phenyl]-2-propanone
Systematic Name English
2-Propanone, 1-(α,α,α-trifluoro-o-tolyl)-
Systematic Name English
2-Propanone, 1-[2-(trifluoromethyl)phenyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
13549861
Created by admin on Sat Dec 16 19:27:05 GMT 2023 , Edited by admin on Sat Dec 16 19:27:05 GMT 2023
PRIMARY
CAS
21235-67-6
Created by admin on Sat Dec 16 19:27:05 GMT 2023 , Edited by admin on Sat Dec 16 19:27:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID60543544
Created by admin on Sat Dec 16 19:27:05 GMT 2023 , Edited by admin on Sat Dec 16 19:27:05 GMT 2023
PRIMARY
FDA UNII
7HVJ2F56C6
Created by admin on Sat Dec 16 19:27:05 GMT 2023 , Edited by admin on Sat Dec 16 19:27:05 GMT 2023
PRIMARY