(Z)-3-(4-(2-(Diethylamino)ethoxy)phenoxy)-4-phenyl-3-buten-2-one citrate
[CAS# 106063-70-1]

Identification

• Name: (Z)-3-(4-(2-(Diethylamino)ethoxy)phenoxy)-4-phenyl-3-buten-2-one citrate
• Synonyms: 2-(Carboxymethyl)-2,4-Dihydroxy-4-Oxo-Butanoate; Diethyl-[2-[4-[(1Z)-2-Oxo-1-(Phenylmethylene)Propoxy]Phenoxy]Ethyl]Ammonium; 2-(Carboxymethyl)-2,4-Dihydroxy-4-Oxobutanoate; Diethyl-[2-[4-[(1Z)-2-Oxo-1-(Phenylmethylene)Propoxy]Phenoxy]Ethyl]Ammonium; 2-[4-[(Z)-1-Acetyl-2-Phenyl-Ethenoxy]Phenoxy]Ethyl-Diethyl-Ammonium; 2-(Carboxymethyl)-2,4-Dihydroxy-4-Keto-Butyrate
• Molecular Formula: C₂₈H₃₅NO₁₀
• Molecular Weight: 545.59
• CAS Registry Number: 106063-70-1
• SMILES: C(C(O)(C([O-])=O)CC(=O)O)C(=O)O.C2=C(OC(=C\C1=CC=CC=C1)/C(=O)C)C=CC(=C2)OCC[NH+](CC)CC
• InChI: 1S/C22H27NO3.C6H8O7/c1-4-23(5-2)15-16-25-20-11-13-21(14-12-20)26-22(18(3)24)17-19-9-7-6-8-10-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h6-14,17H,4-5,15-16H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b22-17-
• InChIKey: WTZPAPRXKGPAKD-JJECXDOKSA-N

Properties

• Boiling point: 506.2°C at 760 mmHg (Cal.)
• Flash point: 260°C (Cal.)