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Details

Stereochemistry ACHIRAL
Molecular Formula C13H10F4N2O2
Molecular Weight 302.2243
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[[2-Fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione

SMILES

CC1=CC(=O)NC(=O)N1CC2=C(C=CC=C2F)C(F)(F)F

InChI

InChIKey=IJRKKZXPXBTHER-UHFFFAOYSA-N
InChI=1S/C13H10F4N2O2/c1-7-5-11(20)18-12(21)19(7)6-8-9(13(15,16)17)3-2-4-10(8)14/h2-5H,6H2,1H3,(H,18,20,21)

HIDE SMILES / InChI

Molecular Formula C13H10F4N2O2
Molecular Weight 302.2243
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 19:20:12 GMT 2023
Edited
by admin
on Sat Dec 16 19:20:12 GMT 2023
Record UNII
T74U83WSC9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[[2-Fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione
Systematic Name English
1-[2-Fluoro-6-(trifluoromethyl)benzyl]-6-methylpyrimidine-2,4(1H,3H)-dione
Systematic Name English
2,4(1H,3H)-Pyrimidinedione, 1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
22037866
Created by admin on Sat Dec 16 19:20:12 GMT 2023 , Edited by admin on Sat Dec 16 19:20:12 GMT 2023
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FDA UNII
T74U83WSC9
Created by admin on Sat Dec 16 19:20:12 GMT 2023 , Edited by admin on Sat Dec 16 19:20:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID90621905
Created by admin on Sat Dec 16 19:20:12 GMT 2023 , Edited by admin on Sat Dec 16 19:20:12 GMT 2023
PRIMARY
CAS
830346-47-9
Created by admin on Sat Dec 16 19:20:12 GMT 2023 , Edited by admin on Sat Dec 16 19:20:12 GMT 2023
PRIMARY