3-(Bis(2-Bromoethyl)Amino)-1-(4-Phenylphenyl)Propan-1-One
[CAS# 142058-13-7]

Identification

• Name: 3-(Bis(2-Bromoethyl)Amino)-1-(4-Phenylphenyl)Propan-1-One
• Synonyms: 1-Propanone, 1-(1,1'-Biphenyl)-4-Yl-3-(Bis(2-Bromoethyl)Amino)-; 4-(3'-Di-(2-Bromoethyl)Aminopropionyl)Biphenyl; Toxin 6
• Molecular Formula: C₁₉H₂₁Br₂NO
• Molecular Weight: 439.19
• CAS Registry Number: 142058-13-7
• SMILES: C1=C(C=CC(=C1)C(CCN(CCBr)CCBr)=O)C2=CC=CC=C2
• InChI: 1S/C19H21Br2NO/c20-11-14-22(15-12-21)13-10-19(23)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9H,10-15H2
• InChIKey: JUMKLYDOIUWANQ-UHFFFAOYSA-N

Properties

• Density: 1.452g/cm³ (Cal.)
• Boiling point: 506.996°C at 760 mmHg (Cal.)
• Flash point: 260.422°C (Cal.)