(Z)-3-(4-(2-(Dimethylamino)propoxy(and 1-methylethoxy))phenoxy)-4-phenyl-3-buten-2-one citrate
[CAS# 106064-07-7]

Identification

• Name: (Z)-3-(4-(2-(Dimethylamino)propoxy(and 1-methylethoxy))phenoxy)-4-phenyl-3-buten-2-one citrate
• Synonyms: 2-(Carboxymethyl)-2,4-Dihydroxy-4-Oxo-Butanoate; Dimethyl-[3-[2-[(1Z)-2-Oxo-1-(Phenylmethylene)Propoxy]Phenoxy]Propyl]Ammonium; 2-(Carboxymethyl)-2,4-Dihydroxy-4-Oxobutanoate; Dimethyl-[3-[2-[(1Z)-2-Oxo-1-(Phenylmethylene)Propoxy]Phenoxy]Propyl]Ammonium; 3-[2-[(Z)-1-Acetyl-2-Phenyl-Ethenoxy]Phenoxy]Propyl-Dimethyl-Ammonium; 2-(Carboxymethyl)-2,4-Dihydroxy-4-Keto-Butyrate
• Molecular Formula: C₂₇H₃₃NO₁₀
• Molecular Weight: 531.56
• CAS Registry Number: 106064-07-7
• SMILES: C2=C(OC(=C\C1=CC=CC=C1)/C(=O)C)C(=CC=C2)OCCC[NH+](C)C.C(C(O)(C([O-])=O)CC(=O)O)C(=O)O
• InChI: 1S/C21H25NO3.C6H8O7/c1-17(23)21(16-18-10-5-4-6-11-18)25-20-13-8-7-12-19(20)24-15-9-14-22(2)3;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-8,10-13,16H,9,14-15H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b21-16-
• InChIKey: JCVIRKVOGNFVBQ-PLMZOXRSSA-N

Properties

• Boiling point: 502.4°C at 760 mmHg (Cal.)
• Flash point: 257.7°C (Cal.)