4-Nitro-N-[(7S)-1,2,3,10-Tetramethoxy-9-Oxo-6,7-Dihydro-5H-Benzo[d]Heptalen-7-Yl]Benzamide
[CAS# 76129-13-0]

Identification

• Name: 4-Nitro-N-[(7S)-1,2,3,10-Tetramethoxy-9-Oxo-6,7-Dihydro-5H-Benzo[d]Heptalen-7-Yl]Benzamide
• Synonyms: N-[(7S)-9-Keto-1,2,3,10-Tetramethoxy-6,7-Dihydro-5H-Benzo[D]Heptalen-7-Yl]-4-Nitro-Benzamide; Benzamide, 4-Nitro-N-(5,6,7,9-Tetrahydro-1,2,3,10-Tetramethoxy-9-Oxobenzo(A)Heptalen-7-Yl)-; Colchicine, N-Deacetyl-N-(P-Nitrobenzoyl)-
• Molecular Formula: C₂₇H₂₆N₂O₈
• Molecular Weight: 506.51
• CAS Registry Number: 76129-13-0
• SMILES: [C@@H]4(NC(=O)C1=CC=C([N+]([O-])=O)C=C1)C2=CC(=O)C(=CC=C2C3=C(C=C(OC)C(=C3OC)OC)CC4)OC
• InChI: 1S/C27H26N2O8/c1-34-22-12-10-18-19(14-21(22)30)20(28-27(31)15-5-8-17(9-6-15)29(32)33)11-7-16-13-23(35-2)25(36-3)26(37-4)24(16)18/h5-6,8-10,12-14,20H,7,11H2,1-4H3,(H,28,31)/t20-/m0/s1
• InChIKey: CRXFDHISRJTSDH-FQEVSTJZSA-N

Properties

• Density: 1.364g/cm³ (Cal.)
• Boiling point: 822.4°C at 760 mmHg (Cal.)
• Flash point: 451.171°C (Cal.)