1-(4-Methylpiperazin-1-Yl)-2-(4-Propan-2-Ylsulfanylphenyl)Propan-1-One Hydrochloride
[CAS# 129603-00-5]

Identification

• Name: 1-(4-Methylpiperazin-1-Yl)-2-(4-Propan-2-Ylsulfanylphenyl)Propan-1-One Hydrochloride
• Synonyms: 2-(4-Isopropylsulfanylphenyl)-1-(4-Methylpiperazin-1-Yl)Propan-1-One Hydrochloride; 2-[4-(Isopropylthio)Phenyl]-1-(4-Methyl-1-Piperazinyl)Propan-1-One Hydrochloride; 2-[4-(Isopropylthio)Phenyl]-1-(4-Methylpiperazin-1-Yl)Propan-1-One Hydrochloride
• Molecular Formula: C₁₇H₂₇ClN₂OS
• Molecular Weight: 342.93
• CAS Registry Number: 129603-00-5
• SMILES: [H+].C2=C(C(C(=O)N1CCN(CC1)C)C)C=CC(=C2)SC(C)C.[Cl-]
• InChI: 1S/C17H26N2OS.ClH/c1-13(2)21-16-7-5-15(6-8-16)14(3)17(20)19-11-9-18(4)10-12-19;/h5-8,13-14H,9-12H2,1-4H3;1H
• InChIKey: NJNJMZHPPSSNJU-UHFFFAOYSA-N

Properties

• Boiling point: 453.4°C at 760 mmHg (Cal.)
• Flash point: 228°C (Cal.)