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Details

Stereochemistry ACHIRAL
Molecular Formula C5H6Cl2O2
Molecular Weight 169.006
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3-DICHLOROPENTANE-2,4-DIONE

SMILES

CC(=O)C(Cl)(Cl)C(C)=O

InChI

InChIKey=WWTZHEACMKQZDG-UHFFFAOYSA-N
InChI=1S/C5H6Cl2O2/c1-3(8)5(6,7)4(2)9/h1-2H3

HIDE SMILES / InChI

Molecular Formula C5H6Cl2O2
Molecular Weight 169.006
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 Wed Apr 02 13:26:28 GMT 2025
Edited
by admin
on Wed Apr 02 13:26:28 GMT 2025
Record UNII
XP3A32Q3QN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3-DICHLOROACETYLACETONE
Preferred Name English
3,3-DICHLOROPENTANE-2,4-DIONE
Systematic Name English
2,4-PENTANEDIONE, 3,3-DICHLORO-
Systematic Name English
Code System Code Type Description
PUBCHEM
118520
Created by admin on Wed Apr 02 13:26:28 GMT 2025 , Edited by admin on Wed Apr 02 13:26:28 GMT 2025
PRIMARY
ECHA (EC/EINECS)
251-615-8
Created by admin on Wed Apr 02 13:26:28 GMT 2025 , Edited by admin on Wed Apr 02 13:26:28 GMT 2025
PRIMARY
FDA UNII
XP3A32Q3QN
Created by admin on Wed Apr 02 13:26:28 GMT 2025 , Edited by admin on Wed Apr 02 13:26:28 GMT 2025
PRIMARY
CAS
33657-50-0
Created by admin on Wed Apr 02 13:26:28 GMT 2025 , Edited by admin on Wed Apr 02 13:26:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID70187337
Created by admin on Wed Apr 02 13:26:28 GMT 2025 , Edited by admin on Wed Apr 02 13:26:28 GMT 2025
PRIMARY