N-[(E)-(2-ethoxy-2-methyl-1-phenylpropylidene)amino]-2,4-dinitroaniline

Base Information

• Chemical Name: N-[(E)-(2-ethoxy-2-methyl-1-phenylpropylidene)amino]-2,4-dinitroaniline
• CAS No.: 7476-50-8
• Molecular Formula: C18H20 N4 O5
• Molecular Weight: 372.3752
• NSC Number: 401776
• DSSTox Substance ID: DTXSID60421535
• Mol file: 7476-50-8.mol

Synonyms:NSC401776;7476-50-8;DTXSID60421535;NSC-401776

Chemical Property of N-[(E)-(2-ethoxy-2-methyl-1-phenylpropylidene)amino]-2,4-dinitroaniline

Chemical Property:

• Vapor Pressure: 6.26E-10mmHg at 25°C
• Boiling Point: 494.8°C at 760 mmHg
• Flash Point: 253°C
• Density: 1.26g/cm³
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 372.14336975
• Heavy Atom Count: 27
• Complexity: 549

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(C)(C)C(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2
• Isomeric SMILES: CCOC(C)(C)/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2=CC=CC=C2