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

Details

Stereochemistry ACHIRAL
Molecular Formula C14H10F2O
Molecular Weight 232.2254
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2,4-DIFLUOROPHENYL)ACETOPHENONE

SMILES

CC(=O)C1=CC=C(C=C1)C2=C(F)C=C(F)C=C2

InChI

InChIKey=HSNQVADZWQJQJJ-UHFFFAOYSA-N
InChI=1S/C14H10F2O/c1-9(17)10-2-4-11(5-3-10)13-7-6-12(15)8-14(13)16/h2-8H,1H3

HIDE SMILES / InChI

Molecular Formula C14H10F2O
Molecular Weight 232.2254
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 12:31:23 GMT 2023
Edited
by admin
on Sat Dec 16 12:31:23 GMT 2023
Record UNII
I6OVJ9PJW3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2,4-DIFLUOROPHENYL)ACETOPHENONE
Systematic Name English
1-(4-(2,4-DIFLUOROPHENYL)PHENYL)ETHAN-1-ONE
Systematic Name English
ETHANONE, 1-(2',4'-DIFLUORO(1,1'-BIPHENYL)-4-YL)-
Systematic Name English
1-(2',4'-DIFLUORO(1,1'-BIPHENYL)-4-YL)ETHAN-1-ONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
258-653-4
Created by admin on Sat Dec 16 12:31:23 GMT 2023 , Edited by admin on Sat Dec 16 12:31:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID30201806
Created by admin on Sat Dec 16 12:31:23 GMT 2023 , Edited by admin on Sat Dec 16 12:31:23 GMT 2023
PRIMARY
FDA UNII
I6OVJ9PJW3
Created by admin on Sat Dec 16 12:31:23 GMT 2023 , Edited by admin on Sat Dec 16 12:31:23 GMT 2023
PRIMARY
PUBCHEM
104542
Created by admin on Sat Dec 16 12:31:23 GMT 2023 , Edited by admin on Sat Dec 16 12:31:23 GMT 2023
PRIMARY
CAS
53591-79-0
Created by admin on Sat Dec 16 12:31:23 GMT 2023 , Edited by admin on Sat Dec 16 12:31:23 GMT 2023
PRIMARY