4-Iodobenzoylacebutolol
[CAS# 72249-70-8]

Identification

• Name: 4-Iodobenzoylacebutolol
• Synonyms: N-[3-Acetyl-4-[2-Hydroxy-3-(Isopropylamino)Propoxy]Phenyl]-4-Iodo-Benzamide; N-[3-Acetyl-4-[2-Hydroxy-3-(Isopropylamino)Propoxy]Phenyl]-4-Iodobenzamide; N-[3-Ethanoyl-4-[2-Hydroxy-3-(Propan-2-Ylamino)Propoxy]Phenyl]-4-Iodo-Benzamide
• Molecular Formula: C₂₁H₂₅IN₂O₄
• Molecular Weight: 496.34
• CAS Registry Number: 72249-70-8
• SMILES: C2=C(NC(=O)C1=CC=C(I)C=C1)C=CC(=C2C(=O)C)OCC(O)CNC(C)C
• InChI: 1S/C21H25IN2O4/c1-13(2)23-11-18(26)12-28-20-9-8-17(10-19(20)14(3)25)24-21(27)15-4-6-16(22)7-5-15/h4-10,13,18,23,26H,11-12H2,1-3H3,(H,24,27)
• InChIKey: XXWRJQCENSSDFR-UHFFFAOYSA-N

Properties

• Density: 1.479g/cm³ (Cal.)
• Boiling point: 554.402°C at 760 mmHg (Cal.)
• Flash point: 289.092°C (Cal.)