5,6,6a,7-Tetrahydro-6-Methyl-4H-Dibenzo[de,g]Quinoline-10,11-Diol Diacetate
[CAS# 6191-56-6]

Identification

• Name: 5,6,6a,7-Tetrahydro-6-Methyl-4H-Dibenzo[de,g]Quinoline-10,11-Diol Diacetate
• Synonyms: 4H-Dibenzo(De,G)Quinoline-10,11-Diol, 5,6,6A,7-Tetrahydro-6-Methyl-, Diacetate (Ester), (R)-; 6A-Beta-Apomorphine-10,11-Diol, Diacetate (Ester) (8Ci); Apomorphine Diacetate
• Molecular Formula: C₂₁H₂₁NO₄
• Molecular Weight: 351.40
• CAS Registry Number: 6191-56-6
• SMILES: [C@H]13N(CCC2=C1C(=CC=C2)C4=C(C3)C=CC(=C4OC(=O)C)OC(=O)C)C
• InChI: 1S/C21H21NO4/c1-12(23)25-18-8-7-15-11-17-19-14(9-10-22(17)3)5-4-6-16(19)20(15)21(18)26-13(2)24/h4-8,17H,9-11H2,1-3H3/t17-/m1/s1
• InChIKey: PJAGGJPKGNYFJH-QGZVFWFLSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 501.872°C at 760 mmHg (Cal.)
• Flash point: 257.323°C (Cal.)