1-[4-(3-Butylamino-2-Hydroxypropoxy)-3-(Propoxymethyl)Phenyl]Ethanone maleate (2:1)
[CAS# 152271-00-6]

Identification

• Name: 1-[4-(3-Butylamino-2-Hydroxypropoxy)-3-(Propoxymethyl)Phenyl]Ethanone maleate (2:1)
• Synonyms: But-2-Enedioic Acid; 1-[4-(3-Butylamino-2-Hydroxy-Propoxy)-3-(Propoxymethyl)Phenyl]Ethanone; 1-[4-(3-Butylamino-2-Hydroxy-Propoxy)-3-(Propoxymethyl)Phenyl]Ethanone; Ethanone, 1-(4-(3-(Butylamino)-2-Hydroxypropoxy)-3-(Propoxymethyl)Phenyl)-, (E)-2-Butenedioate (2:1) (Salt)
• Molecular Formula: C₄₂H₆₆N₂O₁₂
• Molecular Weight: 790.99
• CAS Registry Number: 152271-00-6
• SMILES: C1=C(C(=CC=C1C(=O)C)OCC(O)CNCCCC)COCCC.C2=C(C(=CC=C2C(=O)C)OCC(O)CNCCCC)COCCC.O=C(O)\C=C\C(=O)O
• InChI: 1S/2C19H31NO4.C4H4O4/c2*1-4-6-9-20-12-18(22)14-24-19-8-7-16(15(3)21)11-17(19)13-23-10-5-2;5-3(6)1-2-4(7)8/h2*7-8,11,18,20,22H,4-6,9-10,12-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+
• InChIKey: PCXKEDMATJEFIJ-WXXKFALUSA-N

Properties

• Boiling point: 486.1°C at 760 mmHg (Cal.)
• Flash point: 247.8°C (Cal.)