5-Chloro-3-[2-(4-Methylpiperazin-1-Yl)-2-Oxoethyl]-1,3-Benzothiazol-2-One
[CAS# 33354-22-2]

Identification

• Name: 5-Chloro-3-[2-(4-Methylpiperazin-1-Yl)-2-Oxoethyl]-1,3-Benzothiazol-2-One
• Synonyms: 5-Chloro-3-[2-(4-Methylpiperazin-1-Yl)-2-Oxo-Ethyl]-1,3-Benzothiazol-2-One; 5-Chloro-3-[2-(4-Methyl-1-Piperazinyl)-2-Oxoethyl]-1,3-Benzothiazol-2-One; 5-Chloro-3-[2-Keto-2-(4-Methylpiperazin-1-Yl)Ethyl]-1,3-Benzothiazol-2-One
• Molecular Formula: C₁₄H₁₆ClN₃O₂S
• Molecular Weight: 325.81
• CAS Registry Number: 33354-22-2
• SMILES: C3=C2N(CC(N1CCN(CC1)C)=O)C(SC2=CC=C3Cl)=O
• InChI: 1S/C14H16ClN3O2S/c1-16-4-6-17(7-5-16)13(19)9-18-11-8-10(15)2-3-12(11)21-14(18)20/h2-3,8H,4-7,9H2,1H3
• InChIKey: YODVPSXHHYUKSG-UHFFFAOYSA-N

Properties

• Density: 1.396g/cm³ (Cal.)
• Boiling point: 532.612°C at 760 mmHg (Cal.)
• Flash point: 275.914°C (Cal.)