AC1LPBYA structure

AC1LPBYA

2-[4-[(E)-(2,4-dioxo-3-prop-2-enyl-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy]acetic acid

Also Known As: (4-{(E)-[2,4-dioxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-2-ethoxy-6-iodophenoxy)acetic acid|(E)-2-(4-((3-allyl-2,4-dioxothiazolidin-5-ylidene)methyl)-2-ethoxy-6-iodophenoxy)acetic acid|2-[4-[(E)-(2,4-dioxo-3-prop-2-enyl-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy]acetic acid

CAS: 677331-09-8
Molecular Formula C17H16INO6S
Molecular Weight 488.9743 g/mol
LogP 3.3756
Topological Polar Surface Area 93.14 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 488.9743
Monoisotopic Mass 488.9743
Heavy Atoms 26
Complexity 791.70294

Chemical Identifiers

CAS Number 677331-09-8
SMILES CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)N(C(=O)S2)CC=C)I)OCC(=O)O

Product Overview

AC1LPBYA (CAS 677331-09-8), with molecular formula C17H16INO6S and molecular weight 488.9743 g/mol. IUPAC: 2-[4-[(E)-(2,4-dioxo-3-prop-2-enyl-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy]acetic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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