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Details

Stereochemistry ACHIRAL
Molecular Formula C14H10I2O4
Molecular Weight 496.0357
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-Hydroxyphenoxy)-3,5-diiodobenzeneacetic acid

SMILES

OC(=O)CC1=CC(I)=C(OC2=CC=C(O)C=C2)C(I)=C1

InChI

InChIKey=KKJBNMLZBHFYAE-UHFFFAOYSA-N
InChI=1S/C14H10I2O4/c15-11-5-8(7-13(18)19)6-12(16)14(11)20-10-3-1-9(17)2-4-10/h1-6,17H,7H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C14H10I2O4
Molecular Weight 496.0357
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 20:31:56 GMT 2025
Edited
by admin
on Wed Apr 02 20:31:56 GMT 2025
Record UNII
6X49MHU78S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-90463
Preferred Name English
4-(4-Hydroxyphenoxy)-3,5-diiodobenzeneacetic acid
Systematic Name English
Benzeneacetic acid, 4-(4-hydroxyphenoxy)-3,5-diiodo-
Systematic Name English
Code System Code Type Description
CAS
1155-40-4
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
PRIMARY
PUBCHEM
70862
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-582-0
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
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EPA CompTox
DTXSID40151121
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
PRIMARY
NSC
90463
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
PRIMARY
FDA UNII
6X49MHU78S
Created by admin on Wed Apr 02 20:31:56 GMT 2025 , Edited by admin on Wed Apr 02 20:31:56 GMT 2025
PRIMARY