Ibopamine
[CAS# 66195-31-1]

Identification

• Name: Ibopamine
• Synonyms: 2-Methylpropanoic Acid [5-(2-Methylaminoethyl)-2-(2-Methyl-1-Oxopropoxy)Phenyl] Ester; 2-Methylpropionic Acid [2-Isobutyryloxy-5-(2-Methylaminoethyl)Phenyl] Ester; 4-[2-(Methylamino)Ethyl]Benzene-1,2-Diyl Bis(2-Methylpropanoate)
• Molecular Formula: C₁₇H₂₅NO₄
• Molecular Weight: 307.39
• CAS Registry Number: 66195-31-1
• EINECS: 266-229-5
• SMILES: C1=C(C(=CC(=C1)CCNC)OC(C(C)C)=O)OC(C(C)C)=O
• InChI: 1S/C17H25NO4/c1-11(2)16(19)21-14-7-6-13(8-9-18-5)10-15(14)22-17(20)12(3)4/h6-7,10-12,18H,8-9H2,1-5H3
• InChIKey: WDKXLLJDNUBYCY-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 392.9±37.0°C at 760 mmHg (Cal.)
• Flash point: 191.4±26.5°C (Cal.)