N-[(7S)-1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]propanamide
[CAS# 86495-10-5]

Identification

• Name: N-[(7S)-1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]propanamide
• Synonyms: (S)-N-(5,6,7,9-Tetrahydro-9-oxo-1,2,3,10-tetramethoxybenzo(a)heptalen-7-yl)propionamide; 4-14-00-00951 (Beilstein Handbook Reference); N-(1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-propionamide
• Molecular Formula: C₂₃H₂₇NO₆
• Molecular Weight: 413.46
• CAS Registry Number: 86495-10-5
• SMILES: CCC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
• InChI: 1S/C23H27NO6/c1-6-20(26)24-16-9-7-13-11-19(28-3)22(29-4)23(30-5)21(13)14-8-10-18(27-2)17(25)12-15(14)16/h8,10-12,16H,6-7,9H2,1-5H3,(H,24,26)/t16-/m0/s1
• InChIKey: PVLYMGYXGFBEJB-INIZCTEOSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 728.3±60.0°C at 760 mmHg (Cal.)
• Flash point: 394.3±32.9°C (Cal.)