Alpertine
[CAS# 27076-46-6]

Identification

• Name: Alpertine
• Synonyms: 5,6-Dimethoxy-3-[2-(4-Phenyl-1-Piperazinyl)Ethyl]-1H-Indole-2-Carboxylic Acid Ethyl Ester; 5,6-Dimethoxy-3-[2-(4-Phenylpiperazin-1-Yl)Ethyl]-1H-Indole-2-Carboxylic Acid Ethyl Ester; Ethyl 5,6-Dimethoxy-3-(2-(4-Phenyl-1-Piperazinyl)Ethyl)Indole-2-Carboxylate
• Molecular Formula: C₂₅H₃₁N₃O₄
• Molecular Weight: 437.54
• CAS Registry Number: 27076-46-6
• SMILES: C1=C(OC)C(=CC2=C1C(=C(C(OCC)=O)[NH]2)CCN4CCN(C3=CC=CC=C3)CC4)OC
• InChI: 1S/C25H31N3O4/c1-4-32-25(29)24-19(20-16-22(30-2)23(31-3)17-21(20)26-24)10-11-27-12-14-28(15-13-27)18-8-6-5-7-9-18/h5-9,16-17,26H,4,10-15H2,1-3H3
• InChIKey: RXAVJRAUFOPBOO-UHFFFAOYSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 616.52°C at 760 mmHg (Cal.)
• Flash point: 326.659°C (Cal.)