Febuverine
[CAS# 7077-33-0]

Identification

• Name: Febuverine
• Synonyms: 2-Phenylbutanoic Acid 2-[4-[2-(1-Oxo-2-Phenylbutoxy)Ethyl]-1-Piperazinyl]Ethyl Ester; 2-Phenylbutyric Acid 2-[4-[2-(2-Phenylbutanoyloxy)Ethyl]Piperazin-1-Yl]Ethyl Ester; 1,4-Piperazinediethanol Di(2-Phenylbutyrate Ester).
• Molecular Formula: C₂₈H₃₈N₂O₄
• Molecular Weight: 466.62
• CAS Registry Number: 7077-33-0
• SMILES: C3=C(C(C(OCCN2CCN(CCOC(C(C1=CC=CC=C1)CC)=O)CC2)=O)CC)C=CC=C3
• InChI: 1S/C28H38N2O4/c1-3-25(23-11-7-5-8-12-23)27(31)33-21-19-29-15-17-30(18-16-29)20-22-34-28(32)26(4-2)24-13-9-6-10-14-24/h5-14,25-26H,3-4,15-22H2,1-2H3
• InChIKey: XYCYZUNVTJSIML-UHFFFAOYSA-N

Properties

• Density: 1.096g/cm³ (Cal.)
• Boiling point: 561.658°C at 760 mmHg (Cal.)
• Flash point: 293.481°C (Cal.)