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Details

Stereochemistry ACHIRAL
Molecular Formula C5H4ClNO2
Molecular Weight 145.544
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1H-PYRROLE-2,5-DIONE, 3-CHLORO-4-METHYL

SMILES

CC1=C(Cl)C(=O)NC1=O

InChI

InChIKey=PSOSICZGLLPDFA-UHFFFAOYSA-N
InChI=1S/C5H4ClNO2/c1-2-3(6)5(9)7-4(2)8/h1H3,(H,7,8,9)

HIDE SMILES / InChI

Molecular Formula C5H4ClNO2
Molecular Weight 145.544
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 Mon Mar 31 21:46:19 GMT 2025
Edited
by admin
on Mon Mar 31 21:46:19 GMT 2025
Record UNII
S74CO9002E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-PYRROLE-2,5-DIONE, 3-CHLORO-4-METHYL
Common Name English
3-CHLORO-4-METHYL-1H-PYRROLE-2,5-DIONE
Preferred Name English
Code System Code Type Description
CAS
69636-50-6
Created by admin on Mon Mar 31 21:46:19 GMT 2025 , Edited by admin on Mon Mar 31 21:46:19 GMT 2025
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EPA CompTox
DTXSID60989746
Created by admin on Mon Mar 31 21:46:19 GMT 2025 , Edited by admin on Mon Mar 31 21:46:19 GMT 2025
PRIMARY
PUBCHEM
3017950
Created by admin on Mon Mar 31 21:46:19 GMT 2025 , Edited by admin on Mon Mar 31 21:46:19 GMT 2025
PRIMARY
FDA UNII
S74CO9002E
Created by admin on Mon Mar 31 21:46:19 GMT 2025 , Edited by admin on Mon Mar 31 21:46:19 GMT 2025
PRIMARY