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Details

Stereochemistry ACHIRAL
Molecular Formula C9H5Cl2N3O2
Molecular Weight 258.061
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE

SMILES

ClC1=C(Cl)C(=CC=C1)C2=NNC(=O)NC2=O

InChI

InChIKey=JWSXBRQDWPGEPC-UHFFFAOYSA-N
InChI=1S/C9H5Cl2N3O2/c10-5-3-1-2-4(6(5)11)7-8(15)12-9(16)14-13-7/h1-3H,(H2,12,14,15,16)

HIDE SMILES / InChI

Molecular Formula C9H5Cl2N3O2
Molecular Weight 258.061
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 08:51:35 UTC 2023
Edited
by admin
on Sat Dec 16 08:51:35 UTC 2023
Record UNII
0TKG9E38I9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-(2,3-DICHLOROPHENYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE
Systematic Name English
LAMOTRIGINE IMPURITY D [EP IMPURITY]
Common Name English
1,2,4-TRIAZINE-3,5(2H,4H)-DIONE, 6-(2,3-DICHLOROPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
661463-79-2
Created by admin on Sat Dec 16 08:51:35 UTC 2023 , Edited by admin on Sat Dec 16 08:51:35 UTC 2023
PRIMARY
FDA UNII
0TKG9E38I9
Created by admin on Sat Dec 16 08:51:35 UTC 2023 , Edited by admin on Sat Dec 16 08:51:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID50216336
Created by admin on Sat Dec 16 08:51:35 UTC 2023 , Edited by admin on Sat Dec 16 08:51:35 UTC 2023
PRIMARY
PUBCHEM
53978664
Created by admin on Sat Dec 16 08:51:35 UTC 2023 , Edited by admin on Sat Dec 16 08:51:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP