N-[(E)-1-(furan-2-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-2-iodobenzamide

Base Information

• Chemical Name: N-[(E)-1-(furan-2-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-2-iodobenzamide
• CAS No.: 5980-60-9
• Molecular Formula: C21H17IN2O3
• Molecular Weight: 472.2758
• DSSTox Substance ID: DTXSID60417291
• Wikidata: Q82227101

Synonyms:5980-60-9;N-[(E)-1-(furan-2-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-2-iodobenzamide;AC1NT60R;DTXSID60417291;BIM-0030737.P001

Chemical Property of N-[(E)-1-(furan-2-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-2-iodobenzamide

Chemical Property:

• Vapor Pressure: 2.48E-18mmHg at 25°C
• Boiling Point: 679.7°C at 760 mmHg
• Flash Point: 364.9°C
• Density: 1.589g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 472.02839
• Heavy Atom Count: 27
• Complexity: 558

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)NC(=O)C(=CC2=CC=CO2)NC(=O)C3=CC=CC=C3I
• Isomeric SMILES: CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC=CO2)/NC(=O)C3=CC=CC=C3I

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