(Z)-3-[5-Chloro-2-(2-Piperidin-1-Ium-1-Ylethoxy)Phenoxy]-4-Phenylbut-3-En-2-One Chloride
[CAS# 106064-13-5]

Identification

• Name: (Z)-3-[5-Chloro-2-(2-Piperidin-1-Ium-1-Ylethoxy)Phenoxy]-4-Phenylbut-3-En-2-One Chloride
• Synonyms: (Z)-3-[5-Chloro-2-(2-Piperidin-1-Ium-1-Ylethoxy)Phenoxy]-4-Phenyl-But-3-En-2-One Chloride; (Z)-3-[5-Chloro-2-[2-(1-Piperidin-1-Iumyl)Ethoxy]Phenoxy]-4-Phenylbut-3-En-2-One Chloride; (Z)-3-(5-Chloro-2-(2-Piperidinoethoxy)Phenoxy)-4-Phenyl-3-Buten-2-One Hydrochloride Hydrate
• Molecular Formula: C₂₃H₂₇Cl₂NO₃
• Molecular Weight: 436.38
• CAS Registry Number: 106064-13-5
• SMILES: C1=C(C(=CC=C1Cl)OCC[NH+]2CCCCC2)OC(=C\C3=CC=CC=C3)/C(C)=O.[Cl-]
• InChI: 1S/C23H26ClNO3.ClH/c1-18(26)22(16-19-8-4-2-5-9-19)28-23-17-20(24)10-11-21(23)27-15-14-25-12-6-3-7-13-25;/h2,4-5,8-11,16-17H,3,6-7,12-15H2,1H3;1H/b22-16-
• InChIKey: QAPONSNJCGXVRW-IVVDCSPYSA-N

Properties

• Boiling point: 568.2°C at 760 mmHg (Cal.)
• Flash point: 297.4°C (Cal.)