3-[(E)-3-(3-bromophenyl)-2-phenylprop-2-enoyl]-4,6-dimethyl-1H-pyridin-2-one

Base Information

• Chemical Name: 3-[(E)-3-(3-bromophenyl)-2-phenylprop-2-enoyl]-4,6-dimethyl-1H-pyridin-2-one
• CAS No.: 5401-19-4
• Molecular Formula: C22H18BrNO2
• Molecular Weight: 408.2878
• DSSTox Substance ID: DTXSID30416837
• Wikidata: Q82226417

Synonyms:5401-19-4;3-[(E)-3-(3-bromophenyl)-2-phenylprop-2-enoyl]-4,6-dimethyl-1H-pyridin-2-one;ZINC04954961;DTXSID30416837;CCG-8028;BIM-0019156.P001;3-[3-(3-bromophenyl)-2-phenylacryloyl]-4,6-dimethyl-2(1H)-pyridinone

Chemical Property of 3-[(E)-3-(3-bromophenyl)-2-phenylprop-2-enoyl]-4,6-dimethyl-1H-pyridin-2-one

Chemical Property:

• Vapor Pressure: 9.08E-14mmHg at 25°C
• Boiling Point: 587.2°Cat760mmHg
• Flash Point: 308.9°C
• Density: 1.37g/cm³
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 407.05209
• Heavy Atom Count: 26
• Complexity: 668

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=O)N1)C(=O)C(=CC2=CC(=CC=C2)Br)C3=CC=CC=C3)C
• Isomeric SMILES: CC1=CC(=C(C(=O)N1)C(=O)/C(=C/C2=CC(=CC=C2)Br)/C3=CC=CC=C3)C

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