6-bromo-3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Base Information

• Chemical Name: 6-bromo-3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one
• CAS No.: 5509-44-4
• Molecular Formula: C24H15BrN2O4
• Molecular Weight: 475.2909
• DSSTox Substance ID: DTXSID10416456
• Wikidata: Q82225752
• Mol file: 5509-44-4.mol

Synonyms:5509-44-4;AC1NSHBQ;SCHEMBL6059367;DTXSID10416456;AKOS000636747

Chemical Property of 6-bromo-3-[(E)-3-(3-nitrophenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one

Chemical Property:

• Vapor Pressure: 2.34E-18mmHg at 25°C
• Boiling Point: 680.2°C at 760 mmHg
• Flash Point: 365.2°C
• Density: 1.531g/cm³
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 474.02152
• Heavy Atom Count: 31
• Complexity: 781

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Br)C(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]
• Isomeric SMILES: C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Br)C(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]