2-Chloro-1-(4-Phenylpiperazino)Ethan-1-One
[CAS# 14761-39-8]

Identification

• Name: 2-Chloro-1-(4-Phenylpiperazino)Ethan-1-One
• Synonyms: 2-Chloro-1-(4-Phenyl-1-Piperazinyl)Ethanone; 1-(Chloroacetyl)-4-Phenylpiperazine; Aids-130815
• Molecular Formula: C₁₂H₁₅ClN₂O
• Molecular Weight: 238.72
• CAS Registry Number: 14761-39-8
• SMILES: C1=CC=CC=C1N2CCN(C(CCl)=O)CC2
• InChI: 1S/C12H15ClN2O/c13-10-12(16)15-8-6-14(7-9-15)11-4-2-1-3-5-11/h1-5H,6-10H2
• InChIKey: VHIWWIFXKVGUMK-UHFFFAOYSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 404.66°C at 760 mmHg (Cal.)
• Flash point: 198.531°C (Cal.)

References

• (1): Yong-Ji Xu and Fei Jing . 1-Chloro-2-(4-phenylpiperazin-1-yl)ethanone , Acta Cryst (2009). E65, o1211Â Â