2-[2,6,6-Trimethyl-1,3,8-Trioxo-9-(3,4,5-Trimethoxyphenyl)-7,9-Dihydro-5H-Cyclopenta[b]Quinolin-4-Yl]Acetic Acid
[CAS# 78050-79-0]

Identification

• Name: 2-[2,6,6-Trimethyl-1,3,8-Trioxo-9-(3,4,5-Trimethoxyphenyl)-7,9-Dihydro-5H-Cyclopenta[b]Quinolin-4-Yl]Acetic Acid
• Synonyms: 2-[1,3,8-Triketo-2,6,6-Trimethyl-9-(3,4,5-Trimethoxyphenyl)-7,9-Dihydro-5H-Cyclopenta[B]Quinolin-4-Yl]Acetic Acid; 2-[2,6,6-Trimethyl-1,3,8-Trioxo-9-(3,4,5-Trimethoxyphenyl)-7,9-Dihydro-5H-Cyclopenta[B]Quinolin-4-Yl]Ethanoic Acid; 4H-Cyclopenta(B)Quinoline-4-Acetic Acid, 1,2,3,5,6,7,8,9-Octahydro- 9-(3,4,5-Trimethoxyphenyl)-2,6,6-Trimethyl-1,3,8-Trioxo-
• Molecular Formula: C₂₆H₂₉NO₈
• Molecular Weight: 483.52
• CAS Registry Number: 78050-79-0
• SMILES: C4=C(C1C3=C(N(C2=C1C(=O)CC(C2)(C)C)CC(=O)O)C(=O)C(C3=O)C)C=C(OC)C(=C4OC)OC
• InChI: 1S/C26H29NO8/c1-12-23(31)21-19(13-7-16(33-4)25(35-6)17(8-13)34-5)20-14(9-26(2,3)10-15(20)28)27(11-18(29)30)22(21)24(12)32/h7-8,12,19H,9-11H2,1-6H3,(H,29,30)
• InChIKey: XDMSWKWKYMSCAU-UHFFFAOYSA-N

Properties

• Density: 1.36g/cm³ (Cal.)
• Boiling point: 665.954°C at 760 mmHg (Cal.)
• Flash point: 356.556°C (Cal.)