4-{[1-(Dimethylamino)-3-{2-[2-(3-fluorophenyl)ethyl]phenoxy}-2-propanyl]oxy}-4-oxobutanoic acid hydrochloride (1:1)
[CAS# 86819-21-8]

Identification

• Name: 4-{[1-(Dimethylamino)-3-{2-[2-(3-fluorophenyl)ethyl]phenoxy}-2-propanyl]oxy}-4-oxobutanoic acid hydrochloride (1:1)
• Synonyms: Butanedioic acid, mono(2-(dimethylamino)-1-((2-(2-(3-fluorophenyl)ethyl)phenoxy)methyl)ethyl) ester, hydrochloride
• Molecular Formula: C₂₃H₂₉ClFNO₅
• Molecular Weight: 453.93
• CAS Registry Number: 86819-21-8
• SMILES: Cl.Fc1cccc(c1)CCc2ccccc2OCC(OC(=O)CCC(=O)O)CN(C)C
• InChI: 1S/C23H28FNO5.ClH/c1-25(2)15-20(30-23(28)13-12-22(26)27)16-29-21-9-4-3-7-18(21)11-10-17-6-5-8-19(24)14-17;/h3-9,14,20H,10-13,15-16H2,1-2H3,(H,26,27);1H
• InChIKey: DBBHFAJJKSSLJW-UHFFFAOYSA-N

Properties

• Boiling point: 555.7°C at 760 mmHg (Cal.)
• Flash point: 289.9°C (Cal.)