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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12Cl2O4
Molecular Weight 291.127
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2,3-DICHLORO-4-(1-OXOBUTYL)PHENOXY)ACETIC ACID

SMILES

CCCC(=O)C1=C(Cl)C(Cl)=C(OCC(O)=O)C=C1

InChI

InChIKey=FQAYODYTZPXLRH-UHFFFAOYSA-N
InChI=1S/C12H12Cl2O4/c1-2-3-8(15)7-4-5-9(12(14)11(7)13)18-6-10(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)

HIDE SMILES / InChI

Molecular Formula C12H12Cl2O4
Molecular Weight 291.127
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 19:02:24 UTC 2023
Edited
by admin
on Sat Dec 16 19:02:24 UTC 2023
Record UNII
7NVU96PZ4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2,3-DICHLORO-4-(1-OXOBUTYL)PHENOXY)ACETIC ACID
Systematic Name English
ETACRYNIC ACID IMPURITY A [EP IMPURITY]
Common Name English
(4-BUTANOYL-2,3-DICHLOROPHENOXY)ACETIC ACID
Systematic Name English
ACETIC ACID, 2-(2,3-DICHLORO-4-(1-OXOBUTYL)PHENOXY)-
Systematic Name English
Code System Code Type Description
CAS
1217-67-0
Created by admin on Sat Dec 16 19:02:24 UTC 2023 , Edited by admin on Sat Dec 16 19:02:24 UTC 2023
PRIMARY
FDA UNII
7NVU96PZ4Q
Created by admin on Sat Dec 16 19:02:24 UTC 2023 , Edited by admin on Sat Dec 16 19:02:24 UTC 2023
PRIMARY
PUBCHEM
71036
Created by admin on Sat Dec 16 19:02:24 UTC 2023 , Edited by admin on Sat Dec 16 19:02:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID60153344
Created by admin on Sat Dec 16 19:02:24 UTC 2023 , Edited by admin on Sat Dec 16 19:02:24 UTC 2023
PRIMARY
RS_ITEM_NUM
1256015
Created by admin on Sat Dec 16 19:02:24 UTC 2023 , Edited by admin on Sat Dec 16 19:02:24 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP