3-(4-Nitrobenzylidene)-5-(4-methoxyphenyl)-2,3-dihydrofuran-2-one

Base Information

• Chemical Name: 3-(4-Nitrobenzylidene)-5-(4-methoxyphenyl)-2,3-dihydrofuran-2-one
• CAS No.: 6028-23-5
• Molecular Formula: C18H13NO5
• Molecular Weight: 323.2995
• DSSTox Substance ID: DTXSID20367400
• Nikkaji Number: J2.073.122B
• Wikidata: Q82153218
• Mol file: 6028-23-5.mol

Synonyms:6028-23-5;AC1M4PC9;DTXSID20367400;BIM-0041137.P001;3-(4-Nitrobenzylidene)-5-(4-methoxyphenyl)-2,3-dihydrofuran-2-one

Chemical Property of 3-(4-Nitrobenzylidene)-5-(4-methoxyphenyl)-2,3-dihydrofuran-2-one

Chemical Property:

• Vapor Pressure: 4.75E-12mmHg at 25°C
• Boiling Point: 547.7°C at 760 mmHg
• Flash Point: 242°C
• Density: 1.373g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 323.07937252
• Heavy Atom Count: 24
• Complexity: 546

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=CC(=CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O2
• Isomeric SMILES: COC1=CC=C(C=C1)C2=C/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)O2