Dibusadol
[CAS# 24353-45-5]

Identification

• Name: Dibusadol
• Synonyms: Acetic Acid [2-[(4-Diethylaminobutylamino)-Oxomethyl]Phenyl] Ester; Acetic Acid [2-(4-Diethylaminobutylcarbamoyl)Phenyl] Ester; [2-(4-Diethylaminobutylcarbamoyl)Phenyl] Ethanoate
• Molecular Formula: C₁₇H₂₆N₂O₃
• Molecular Weight: 306.40
• CAS Registry Number: 24353-45-5
• SMILES: C1=CC=CC(=C1C(NCCCCN(CC)CC)=O)OC(C)=O
• InChI: 1S/C17H26N2O3/c1-4-19(5-2)13-9-8-12-18-17(21)15-10-6-7-11-16(15)22-14(3)20/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H,18,21)
• InChIKey: OXCRVQDEVWYAJE-UHFFFAOYSA-N

Properties

• Density: 1.056g/cm³ (Cal.)
• Boiling point: 451.935°C at 760 mmHg (Cal.)
• Flash point: 227.122°C (Cal.)