Elymoclavine
[CAS# 548-43-6]

Identification

• Name: Elymoclavine
• Synonyms: Aids-226154; Aids226154; C06068
• Molecular Formula: C₁₆H₁₈N₂O
• Molecular Weight: 254.33
• CAS Registry Number: 548-43-6
• EINECS: 208-948-9
• SMILES: [C@H]14[C@@H](CC2=C[NH]C3=CC=CC1=C23)N(CC(=C4)CO)C
• InChI: 1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,13,15,17,19H,6,8-9H2,1H3/t13-,15-/m1/s1
• InChIKey: DAVNRFCJMIONPO-UKRRQHHQSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 468.0±45.0°C at 760 mmHg (Cal.)
• Flash point: 236.8±28.7°C (Cal.)