AC1NYKJO structure

AC1NYKJO

ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate

Also Known As: (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate|3-benzothiazol-2-yl-2-(ethoxycarbonyl)-4-oxochromen-7-yl (2E)-3-phenylprop-2-e noate|Ethyl 3-benzothiazol-2-yl-4-oxo-7-(3-phenylprop-2-enoyloxy)chromene-2-carboxylate|ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate|ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-{[(2E)-3-phenylprop-2-enoyl]oxy}-4H-chromene-2-carboxylate

CAS: 637747-75-2
Molecular Formula C28H19NO6S
Molecular Weight 497.09332 g/mol
LogP 5.8652
Topological Polar Surface Area 95.7 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 497.09332
Monoisotopic Mass 497.09332
Heavy Atoms 36
Complexity 1650.5188

Chemical Identifiers

CAS Number 637747-75-2
SMILES CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)/C=C/C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Product Overview

AC1NYKJO (CAS 637747-75-2), with molecular formula C28H19NO6S and molecular weight 497.09332 g/mol. IUPAC: ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate.

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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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