Clopenthixol
[CAS# 982-24-1]

Identification

• Name: Clopenthixol
• Synonyms: 2-[4-[(3E)-3-(2-Chlorothioxanthen-9-Ylidene)Propyl]Piperazin-1-Yl]Ethanol; 2-[4-[3-(2-Chloro-9-Thioxanthenylidene)Propyl]-1-Piperazinyl]Ethanol; 2-[4-[(3E)-3-(2-Chloro-9-Thioxanthenylidene)Propyl]-1-Piperazinyl]Ethanol
• Molecular Formula: C₂₂H₂₅ClN₂OS
• Molecular Weight: 400.97
• CAS Registry Number: 982-24-1
• EINECS: 213-566-0
• SMILES: C2=CC=C1C(/C3=C(SC1=C2)C=CC(=C3)Cl)=C\CCN4CCN(CCO)CC4
• InChI: 1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5+
• InChIKey: WFPIAZLQTJBIFN-BLLMUTORSA-N

Properties

• Density: 1.29g/cm³ (Cal.)
• Boiling point: 577.442°C at 760 mmHg (Cal.)
• Flash point: 303.026°C (Cal.)