N-Benzoyl-4-[Bis(2-Chloroethyl)Amino]Phenylalanine
[CAS# 60557-40-6]

Identification

• Name: N-Benzoyl-4-[Bis(2-Chloroethyl)Amino]Phenylalanine
• Synonyms: 2-Benzamido-3-(4-(N,N-bis(2-chloroethyl)amino)phenyl)propionicacid
• Molecular Formula: C₂₀H₂₂Cl₂N₂O₃
• Molecular Weight: 409.31
• CAS Registry Number: 60557-40-6
• SMILES: c1ccc(cc1)C(=O)NC(Cc2ccc(cc2)N(CCCl)CCCl)C(=O)O
• InChI: 1S/C20H22Cl2N2O3/c21-10-12-24(13-11-22)17-8-6-15(7-9-17)14-18(20(26)27)23-19(25)16-4-2-1-3-5-16/h1-9,18H,10-14H2,(H,23,25)(H,26,27)
• InChIKey: ATUOEZURORVULU-UHFFFAOYSA-N

Properties

• Density: 1.311g/cm³ (Cal.)
• Boiling point: 653.222°C at 760 mmHg (Cal.)
• Flash point: 348.857°C (Cal.)