N-[(E)-2,2-diethylbutylideneamino]-2,4-dinitroaniline

Base Information

• Chemical Name: N-[(E)-2,2-diethylbutylideneamino]-2,4-dinitroaniline
• CAS No.: 7498-77-3
• Molecular Formula: C14H20 N4 O4
• Molecular Weight: 308.333
• NSC Number: 407583
• DSSTox Substance ID: DTXSID00430444

Synonyms:NSC407583;7498-77-3;DTXSID00430444;NSC-407583

Chemical Property of N-[(E)-2,2-diethylbutylideneamino]-2,4-dinitroaniline

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 435.42°C at 760 mmHg
• Flash Point: 217.135°C
• Density: 1.222g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 308.14845513
• Heavy Atom Count: 22
• Complexity: 404

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)(CC)C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
• Isomeric SMILES: CCC(CC)(CC)/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

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