AC1NZ9UT structure

AC1NZ9UT

[4-[(E)-3-(2-chloro-4-nitroanilino)-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-chlorobenzoate

Also Known As: [4-[(E)-3-(2-chloro-4-nitroanilino)-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-chlorobenzoate|[4-[2-[(2-chloro-4-nitro-phenyl)carbamoyl]-2-cyano-ethenyl]-2-methoxy-phenyl] 4-chlorobenzoate|4-{2-[(2-chloro-4-nitrophenyl)carbamoyl]-2-cyanoeth-1-en-1-yl}-2-methoxyphenyl 4-chlorobenzoate

CAS: 522656-57-1
Molecular Formula C24H15Cl2N3O6
Molecular Weight 511.03378 g/mol
LogP 5.67508
Topological Polar Surface Area 131.56 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 511.03378
Monoisotopic Mass 511.03378
Heavy Atoms 35
Complexity 1380.9971

Chemical Identifiers

CAS Number 522656-57-1
SMILES COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC(=O)C3=CC=C(C=C3)Cl

Product Overview

AC1NZ9UT (CAS 522656-57-1), with molecular formula C24H15Cl2N3O6 and molecular weight 511.03378 g/mol. IUPAC: [4-[(E)-3-(2-chloro-4-nitroanilino)-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-chlorobenzoate.

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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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