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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7IO3
Molecular Weight 278.0439
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Hydroxy-4-iodobenzoic acid methyl ester

SMILES

COC(=O)C1=CC=C(I)C(O)=C1

InChI

InChIKey=LXCQVWRESZDFGW-UHFFFAOYSA-N
InChI=1S/C8H7IO3/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,10H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Benzoic acid, 3-hydroxy-4-iodo-, methyl ester
Preferred Name English
3-Hydroxy-4-iodobenzoic acid methyl ester
Systematic Name English
Methyl 3-hydroxy-4-iodobenzoate
Systematic Name English
Code System Code Type Description
FDA UNII
37K792YP65
Created by admin on Wed Apr 02 15:39:14 GMT 2025 , Edited by admin on Wed Apr 02 15:39:14 GMT 2025
PRIMARY
PUBCHEM
10378812
Created by admin on Wed Apr 02 15:39:14 GMT 2025 , Edited by admin on Wed Apr 02 15:39:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID10439009
Created by admin on Wed Apr 02 15:39:14 GMT 2025 , Edited by admin on Wed Apr 02 15:39:14 GMT 2025
PRIMARY
CAS
157942-12-6
Created by admin on Wed Apr 02 15:39:14 GMT 2025 , Edited by admin on Wed Apr 02 15:39:14 GMT 2025
PRIMARY
NIH
NCATS
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