Actinodaphine
[CAS# 517-69-1]

Identification

• Name: Actinodaphine
• Synonyms: Chebi:2444; 5H-Benzo(G)-1,3-Benzodioxo(6,5,4-De)Quinoline-10-Ol, 6,7,7A,8-Tetrahydro-1-Methoxy-, (G)-; Actinodaphine
• Molecular Formula: C₁₈H₁₇NO₄
• Molecular Weight: 311.34
• CAS Registry Number: 517-69-1
• SMILES: [C@H]25CC1=CC(=C(C=C1C3=C2C(=CC4=C3OCO4)CCN5)OC)O
• InChI: 1S/C18H17NO4/c1-21-14-7-11-10(5-13(14)20)4-12-16-9(2-3-19-12)6-15-18(17(11)16)23-8-22-15/h5-7,12,19-20H,2-4,8H2,1H3/t12-/m0/s1
• InChIKey: VYJUHRAQPIBWNV-LBPRGKRZSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 527.5±50.0°C at 760 mmHg (Cal.)
• Flash point: 272.8±30.1°C (Cal.)