6-(Acridin-9-Ylamino)-1-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Hexan-1-One
[CAS# 125173-79-7]

Identification

• Name: 6-(Acridin-9-Ylamino)-1-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Hexan-1-One
• Synonyms: 6-(9-Acridinylamino)-1-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Hexan-1-One; 6-(9-Acridinylamino)-1-(4-(Bis(2-Chloroethyl)Amino)Phenyl)-1-Hexanone; 1-Hexanone, 6-(9-Acridinylamino)-1-(4-(Bis(2-Chloroethyl)Amino)Phenyl)-
• Molecular Formula: C₂₉H₃₁Cl₂N₃O
• Molecular Weight: 508.49
• CAS Registry Number: 125173-79-7
• SMILES: C1=CC(=CC=C1C(CCCCCNC3=C2C=CC=CC2=NC4=C3C=CC=C4)=O)N(CCCl)CCCl
• InChI: 1S/C29H31Cl2N3O/c30-17-20-34(21-18-31)23-15-13-22(14-16-23)28(35)12-2-1-7-19-32-29-24-8-3-5-10-26(24)33-27-11-6-4-9-25(27)29/h3-6,8-11,13-16H,1-2,7,12,17-21H2,(H,32,33)
• InChIKey: ZBXRYMWSCXGVMN-UHFFFAOYSA-N

Properties

• Density: 1.252g/cm³ (Cal.)
• Boiling point: 723.135°C at 760 mmHg (Cal.)
• Flash point: 391.138°C (Cal.)