Borrecapine
[CAS# 66408-14-8]

Identification

• Name: Borrecapine
• Synonyms: 1H-Indol-3-Yl-[(2R,3R,5S)-3-Methyl-5-(2-Methylprop-1-Enyl)-3-Vinyl-Pyrrolidin-2-Yl]Methanone; 1H-Indol-3-Yl-[(2R,3R,5S)-3-Methyl-5-(2-Methylprop-1-Enyl)-3-Vinyl-2-Pyrrolidinyl]Methanone; Borrecapine
• Molecular Formula: C₂₀H₂₄N₂O
• Molecular Weight: 308.42
• CAS Registry Number: 66408-14-8
• SMILES: [C@]1([C@@H](N[C@@H](C1)C=C(C)C)C(=O)C2=C[NH]C3=CC=CC=C23)(C)C=C
• InChI: 1S/C20H24N2O/c1-5-20(4)11-14(10-13(2)3)22-19(20)18(23)16-12-21-17-9-7-6-8-15(16)17/h5-10,12,14,19,21-22H,1,11H2,2-4H3/t14-,19+,20+/m1/s1
• InChIKey: ZSWYXBSEVUNDFU-UAOJZALGSA-N

Properties

• Density: 1.161g/cm³ (Cal.)
• Boiling point: 475.73°C at 760 mmHg (Cal.)
• Flash point: 241.513°C (Cal.)