2-[2-[Bis(2-Chloroethyl)Amino]Ethyl]Isoindole-1,3-Dione
[CAS# 156250-83-8]

Identification

• Name: 2-[2-[Bis(2-Chloroethyl)Amino]Ethyl]Isoindole-1,3-Dione
• Synonyms: 2-[2-[Bis(2-Chloroethyl)Amino]Ethyl]Isoindoline-1,3-Dione; 2-[2-[Bis(2-Chloroethyl)Amino]Ethyl]Isoindoline-1,3-Quinone; Phthalmustine
• Molecular Formula: C₁₄H₁₆Cl₂N₂O₂
• Molecular Weight: 315.20
• CAS Registry Number: 156250-83-8
• SMILES: C1=CC=CC2=C1C(N(CCN(CCCl)CCCl)C2=O)=O
• InChI: 1S/C14H16Cl2N2O2/c15-5-7-17(8-6-16)9-10-18-13(19)11-3-1-2-4-12(11)14(18)20/h1-4H,5-10H2
• InChIKey: WBSOXOXZQOTHHV-UHFFFAOYSA-N

Properties

• Density: 1.334g/cm³ (Cal.)
• Boiling point: 379.239°C at 760 mmHg (Cal.)
• Flash point: 183.157°C (Cal.)