Deacetyldiaboline
[CAS# 466-85-3]

Identification

• Name: Deacetyldiaboline
• Synonyms: 1-Deacetyldiaboline; Caracurine; Caracurine Vii
• Molecular Formula: C₁₉H₂₂N₂O₂
• Molecular Weight: 310.40
• CAS Registry Number: 466-85-3
• SMILES: [C@@]245[C@H]([C@@H]1[C@@H](OCC=C3[C@@H]1C[C@@H]2N(C3)CC4)O)NC6=CC=CC=C56
• InChI: 1S/C19H22N2O2/c22-18-16-12-9-15-19(6-7-21(15)10-11(12)5-8-23-18)13-3-1-2-4-14(13)20-17(16)19/h1-5,12,15-18,20,22H,6-10H2/t12-,15-,16+,17-,18+,19+/m0/s1
• InChIKey: UFUDXCDPABDFHK-SRCYXDNASA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 536.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 278.2±30.1°C (Cal.)