1-(4-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)-3-(Propoxymethyl)Phenyl)-1-Propanone (E)-2-Butenedioate (2:1) (Salt)
[CAS# 106909-37-9]

Identification

• Name: 1-(4-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)-3-(Propoxymethyl)Phenyl)-1-Propanone (E)-2-Butenedioate (2:1) (Salt)
• Synonyms: But-2-Enedioic Acid; 1-[4-[2-Hydroxy-3-(Isopropylamino)Propoxy]-3-(Propoxymethyl)Phenyl]Propan-1-One; 1-[4-[2-Hydroxy-3-(Isopropylamino)Propoxy]-3-(Propoxymethyl)Phenyl]Propan-1-One; 1-(4-(2-Hydroxy-3-(Isopropylamino)Propoxy)-3-(Propoxymethyl)Phenyl)Propanone Maleate (2:1); 1-Propanone, 1-(4-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)-3-(Propoxymethyl)Phenyl)-, (E)-2-Butenedioate (2:1) (Salt)
• Molecular Formula: C₄₂H₆₆N₂O₁₂
• Molecular Weight: 790.99
• CAS Registry Number: 106909-37-9
• SMILES: C1=C(C(=CC=C1C(=O)CC)OCC(O)CNC(C)C)COCCC.C2=C(C(=CC=C2C(=O)CC)OCC(O)CNC(C)C)COCCC.O=C(O)\C=C\C(=O)O
• InChI: 1S/2C19H31NO4.C4H4O4/c2*1-5-9-23-12-16-10-15(18(22)6-2)7-8-19(16)24-13-17(21)11-20-14(3)4;5-3(6)1-2-4(7)8/h2*7-8,10,14,17,20-21H,5-6,9,11-13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+
• InChIKey: AXQSBOWITCRVSF-WXXKFALUSA-N

Properties

• Boiling point: 481.2°C at 760 mmHg (Cal.)
• Flash point: 244.8°C (Cal.)