4-{[1-(Dimethylamino)-3-(2-{2-[4-(dimethylamino)phenyl]ethyl}phenoxy)-2-propanyl]oxy}-4-oxobutanoic acid dihydrochloride
[CAS# 86819-19-4]

Identification

• Name: 4-{[1-(Dimethylamino)-3-(2-{2-[4-(dimethylamino)phenyl]ethyl}phenoxy)-2-propanyl]oxy}-4-oxobutanoic acid dihydrochloride
• Synonyms: Butanedioic acid, mono(2-(dimethylamino)-1-((2-(2-(4- (dimethylamino)phenyl)ethyl)phenoxy)methyl)ethyl) ester, dihydrochloride
• Molecular Formula: C₂₅H₃₆Cl₂N₂O₅
• Molecular Weight: 515.47
• CAS Registry Number: 86819-19-4
• SMILES: Cl.Cl.O=C(O)CCC(=O)OC(COc1ccccc1CCc2ccc(N(C)C)cc2)CN(C)C
• InChI: 1S/C25H34N2O5.2ClH/c1-26(2)17-22(32-25(30)16-15-24(28)29)18-31-23-8-6-5-7-20(23)12-9-19-10-13-21(14-11-19)27(3)4;;/h5-8,10-11,13-14,22H,9,12,15-18H2,1-4H3,(H,28,29);2*1H
• InChIKey: UOWCWVIUCLJTSU-UHFFFAOYSA-N

Properties

• Boiling point: 602.4°C at 760 mmHg (Cal.)
• Flash point: 318.1°C (Cal.)