AC1M0L8V structure

AC1M0L8V

[(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 4-methoxybenzenesulfonate

Also Known As: (Z)-3-oxo-2-(pyridin-4-ylmethylene)-2,3-dihydrobenzofuran-6-yl 4-methoxybenzenesulfonate|F3385-2481|[(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 4-methoxybenzenesulfonate|(2Z)-3-oxo-2-[(pyridin-4-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzene-1-sulfonate|6-(4-methoxyphenyl)sulfonyloxy-2-(pyridin-4-ylmethylidene)benzofuran-3-one|3-oxo-2-(4-pyridylmethylene)benzo[3,4-b]furan-6-yl 4-methoxybenzenesulfonate|(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzenesulfonate

CAS: 899398-40-4
Molecular Formula C21H15NO6S
Molecular Weight 409.062 g/mol
LogP 3.4741
Topological Polar Surface Area 91.79 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 409.062
Monoisotopic Mass 409.062
Heavy Atoms 29
Complexity 1201.6786

Chemical Identifiers

CAS Number 899398-40-4
SMILES COC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=NC=C4)/O3

Product Overview

AC1M0L8V (CAS 899398-40-4), with molecular formula C21H15NO6S and molecular weight 409.062 g/mol. IUPAC: [(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-1-benzofuran-6-yl] 4-methoxybenzenesulfonate.

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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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