AC1LK5TP structure

AC1LK5TP

[4-[(E)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] 2-methylpropanoate

Also Known As: AK-968/15254238|[4-[(E)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] 2-methylpropanoate|4-[(2-{2-chloro-4-nitrophenyl}-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-2-methoxyphenyl 2-methylpropanoate|(E)-4-((2-(2-chloro-4-nitrophenyl)-5-oxooxazol-4(5H)-ylidene)methyl)-2-methoxyphenyl isobutyrate|4-{(E)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-methoxyphenyl 2-methylpropanoate|4-{[2-(2-CHLORO-4-NITROPHENYL)-5-OXO-1,3-OXAZOL-4(5H)-YLIDEN]METHYL}-2-METHOXYPHENYL 2-METHYLPROPANOATE

CAS: 445287-06-9
Molecular Formula C21H17ClN2O7
Molecular Weight 444.07242 g/mol
LogP 4.1627
Topological Polar Surface Area 117.33 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 444.07242
Monoisotopic Mass 444.07242
Heavy Atoms 31
Complexity 1138.5433

Chemical Identifiers

CAS Number 445287-06-9
SMILES CC(C)C(=O)OC1=C(C=C(C=C1)/C=C/2\C(=O)OC(=N2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)OC

Product Overview

AC1LK5TP (CAS 445287-06-9), with molecular formula C21H17ClN2O7 and molecular weight 444.07242 g/mol. IUPAC: [4-[(E)-[2-(2-chloro-4-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]-2-methoxyphenyl] 2-methylpropanoate.

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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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