5-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Methylidene]-1,3-Diazinane-2,4,6 -Trione
[CAS# 68961-21-7]

Identification

• Name: 5-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Methylidene]-1,3-Diazinane-2,4,6 -Trione
• Synonyms: 5-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Methylene]Hexahydropyrimidine-2,4,6-Trione; 5-[4-[Bis(2-Chloroethyl)Amino]Benzylidene]Barbituric Acid; Zinc03034075
• Molecular Formula: C₁₅H₁₅Cl₂N₃O₃
• Molecular Weight: 356.21
• CAS Registry Number: 68961-21-7
• SMILES: C2=C(C=C1C(=O)NC(=O)NC1=O)C=CC(=C2)N(CCCl)CCCl
• InChI: 1S/C15H15Cl2N3O3/c16-5-7-20(8-6-17)11-3-1-10(2-4-11)9-12-13(21)18-15(23)19-14(12)22/h1-4,9H,5-8H2,(H2,18,19,21,22,23)
• InChIKey: VMTWXIRNUYZQPN-UHFFFAOYSA-N

Properties

• Density: 1.427g/cm³ (Cal.)