N-[3-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Sulfanylpropyl]Acridin-9-Amine
[CAS# 130031-49-1]

Identification

• Name: N-[3-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Sulfanylpropyl]Acridin-9-Amine
• Synonyms: N-[3-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Thio]Propyl]-9-Acridinamine; Acridin-9-Yl-[3-[[4-[Bis(2-Chloroethyl)Amino]Phenyl]Thio]Propyl]Amine; N-(3-((4-(Bis(2-Chloroethyl)Amino)Phenyl)Thio)Propyl)-9-Acridinamine
• Molecular Formula: C₂₆H₂₇Cl₂N₃S
• Molecular Weight: 484.49
• CAS Registry Number: 130031-49-1
• SMILES: C1=CC(=CC=C1N(CCCl)CCCl)SCCCNC3=C2C=CC=CC2=NC4=CC=CC=C34
• InChI: 1S/C26H27Cl2N3S/c27-14-17-31(18-15-28)20-10-12-21(13-11-20)32-19-5-16-29-26-22-6-1-3-8-24(22)30-25-9-4-2-7-23(25)26/h1-4,6-13H,5,14-19H2,(H,29,30)
• InChIKey: FSJFMSCJJZGVHC-UHFFFAOYSA-N

Properties

• Density: 1.296g/cm³ (Cal.)
• Boiling point: 686.107°C at 760 mmHg (Cal.)
• Flash point: 368.745°C (Cal.)