AC1LX2OY structure

AC1LX2OY

(4Z)-4-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-2-(4-methyl-3-nitrophenyl)-1,3-oxazol-5-one

Also Known As: AK-968/12346468|4-{3-bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}-2-{3-nitro-4-methylphenyl}-1,3-oxazol-5(4H)-one|(4Z)-4-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-2-(4-methyl-3-nitrophenyl)-1,3-oxazol-5-one

CAS: 445251-07-0
Molecular Formula C26H21BrN2O6
Molecular Weight 536.0583 g/mol
LogP 5.90624
Topological Polar Surface Area 100.26 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 536.0583
Monoisotopic Mass 536.0583
Heavy Atoms 35
Complexity 1379.3346

Chemical Identifiers

CAS Number 445251-07-0
SMILES CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)/C=C\3/C(=O)OC(=N3)C4=CC(=C(C=C4)C)[N+](=O)[O-])OC

Product Overview

AC1LX2OY (CAS 445251-07-0), with molecular formula C26H21BrN2O6 and molecular weight 536.0583 g/mol. IUPAC: (4Z)-4-[[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methylidene]-2-(4-methyl-3-nitrophenyl)-1,3-oxazol-5-one.

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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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