3-[Bis(2-Chloroethyl)Amino]-4'-(Bromoacetyl)-4-Methylbenzanilide
[CAS# 70020-69-8]

Identification

• Name: 3-[Bis(2-Chloroethyl)Amino]-4'-(Bromoacetyl)-4-Methylbenzanilide
• Synonyms: 3-[Bis(2-Chloroethyl)Amino]-N-[4-(2-Bromoacetyl)Phenyl]-4-Methyl-Benzamide; 3-[Bis(2-Chloroethyl)Amino]-N-[4-(2-Bromo-1-Oxoethyl)Phenyl]-4-Methylbenzamide; 3-[Bis(2-Chloroethyl)Amino]-N-[4-(2-Bromoethanoyl)Phenyl]-4-Methyl-Benzamide
• Molecular Formula: C₂₀H₂₁BrCl₂N₂O₂
• Molecular Weight: 472.21
• CAS Registry Number: 70020-69-8
• SMILES: C1=C(N(CCCl)CCCl)C(=CC=C1C(NC2=CC=C(C=C2)C(CBr)=O)=O)C
• InChI: 1S/C20H21BrCl2N2O2/c1-14-2-3-16(12-18(14)25(10-8-22)11-9-23)20(27)24-17-6-4-15(5-7-17)19(26)13-21/h2-7,12H,8-11,13H2,1H3,(H,24,27)
• InChIKey: JBZCGJYFIJGJEL-UHFFFAOYSA-N

Properties

• Density: 1.462g/cm³ (Cal.)
• Boiling point: 540.762°C at 760 mmHg (Cal.)
• Flash point: 280.843°C (Cal.)