4-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Imino]-2,5-Cyclohexadien-1-One
[CAS# 64048-64-2]

Identification

• Name: 4-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Imino]-2,5-Cyclohexadien-1-One
• Synonyms: 4-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Imino-1-Cyclohexa-2,5-Dienone; Nsc260638; N-(4'-Di-2''-Chloroethylaminophenyl)Benzoquinoneimine
• Molecular Formula: C₁₆H₁₆Cl₂N₂O
• Molecular Weight: 323.22
• CAS Registry Number: 64048-64-2
• SMILES: C1=C(N(CCCl)CCCl)C=CC(=C1)N=C2C=CC(=O)C=C2
• InChI: 1S/C16H16Cl2N2O/c17-9-11-20(12-10-18)15-5-1-13(2-6-15)19-14-3-7-16(21)8-4-14/h1-8H,9-12H2
• InChIKey: LUKFYERPDCANBJ-UHFFFAOYSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 462.955°C at 760 mmHg (Cal.)
• Flash point: 233.787°C (Cal.)