3-[Amino-[Bis(2-Chloroethyl)Amino]Phosphoryl]Oxy-1-Phenyl-Propan-1-One
[CAS# 100993-68-8]

Identification

• Name: 3-[Amino-[Bis(2-Chloroethyl)Amino]Phosphoryl]Oxy-1-Phenyl-Propan-1-One
• Synonyms: 3-[Amino-[Bis(2-Chloroethyl)Amino]Phosphoryl]Oxy-1-Phenyl-Propan-1-One; Nsc369936; Phosphorodiamidic Acid, N,N-Bis(2-Chloroethyl)-, (2-Benzoyl)Ethyl Ester
• Molecular Weight: 353.18
• CAS Registry Number: 100993-68-8
• SMILES: C1=C(C(CCO[P](N(CCCl)CCCl)(=O)N)=O)C=CC=C1
• InChI: 1S/C13H19Cl2N2O3P/c14-7-9-17(10-8-15)21(16,19)20-11-6-13(18)12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,16,19)
• InChIKey: ZSQIOJOQXJELQB-UHFFFAOYSA-N

Properties

• Density: 1.319g/cm³ (Cal.)
• Boiling point: 491.207°C at 760 mmHg (Cal.)
• Flash point: 250.873°C (Cal.)