5-Chloro-3-[2-[4-(2-Hydroxypropyl)Piperazin-4-Ium-1-Yl]-2-Oxoethyl]-1,3-Benzothiazol-2-One Chloride
[CAS# 32527-53-0]

Identification

• Name: 5-Chloro-3-[2-[4-(2-Hydroxypropyl)Piperazin-4-Ium-1-Yl]-2-Oxoethyl]-1,3-Benzothiazol-2-One Chloride
• Synonyms: 5-Chloro-3-[2-[4-(2-Hydroxypropyl)Piperazin-4-Ium-1-Yl]-2-Oxo-Ethyl]-1,3-Benzothiazol-2-One Chloride; 5-Chloro-3-[2-[4-(2-Hydroxypropyl)-1-Piperazin-4-Iumyl]-2-Oxoethyl]-1,3-Benzothiazol-2-One Chloride; 5-Chloro-3-[2-[4-(2-Hydroxypropyl)Piperazin-4-Ium-1-Yl]-2-Keto-Ethyl]-1,3-Benzothiazol-2-One Chloride
• Molecular Formula: C₁₆H₂₁Cl₂N₃O₃S
• Molecular Weight: 406.33
• CAS Registry Number: 32527-53-0
• SMILES: C1=C(Cl)C=CC3=C1N(CC(=O)N2CC[NH+](CC(O)C)CC2)C(S3)=O.[Cl-]
• InChI: 1S/C16H20ClN3O3S.ClH/c1-11(21)9-18-4-6-19(7-5-18)15(22)10-20-13-8-12(17)2-3-14(13)24-16(20)23;/h2-3,8,11,21H,4-7,9-10H2,1H3;1H
• InChIKey: SWMPOMJQLSHCRO-UHFFFAOYSA-N

Properties

• Boiling point: 603.5°C at 760 mmHg (Cal.)
• Flash point: 318.8°C (Cal.)