1-(2,4-Dinitroanilino)-5-(methoxyimino)-3-phenyl-1,3-pentadiene

Base Information

• Chemical Name: 1-(2,4-Dinitroanilino)-5-(methoxyimino)-3-phenyl-1,3-pentadiene
• CAS No.: 71130-61-5
• Molecular Formula: C18H16N4O5
• Molecular Weight: 368.34
• DSSTox Substance ID: DTXSID7072258
• Mol file: 71130-61-5.mol

Synonyms:1-(2,4-Dinitroanilino)-5-(methoxyimino)-3-phenyl-1,3-pentadiene;2,4-Pentadienal, 5-((2,4-dinitrophenyl)amino)-3-phenyl-, O-methyloxime;2,4-Pentadienal, 5-[(2,4-dinitrophenyl)amino]-3-phenyl-, O-methyloxime;DTXSID7072258

Chemical Property of 1-(2,4-Dinitroanilino)-5-(methoxyimino)-3-phenyl-1,3-pentadiene

Chemical Property:

• Vapor Pressure: 4.44E-11mmHg at 25°C
• Boiling Point: 524.1°C at 760 mmHg
• Flash Point: 270.8°C
• PSA: 125.26000
• Density: 1.26g/cm³
• LogP: 5.39090
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 368.11206962
• Heavy Atom Count: 27
• Complexity: 588

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CONC=CC(=CC=NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2
• Isomeric SMILES: CON/C=C/C(=C/C=NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC=CC=C2

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