Ammonium 1-Ethyl 2,7-Dihydro-3-Methyl-6-[(4-Methyl-2-Sulphonatophenyl)Amino]-2,7-Dioxo-3H-Dibenz[f,ij]Isoquinoline-1-Carboxylate
[CAS# 63149-14-4]

Identification

• Name: Ammonium 1-Ethyl 2,7-Dihydro-3-Methyl-6-[(4-Methyl-2-Sulphonatophenyl)Amino]-2,7-Dioxo-3H-Dibenz[f,ij]Isoquinoline-1-Carboxylate
• Synonyms: Ammonium 1-Ethyl 2,7-Dihydro-3-Methyl-6-((4-Methyl-2-Sulphonatophenyl)Amino)-2,7-Dioxo-3H-Dibenz(F,Ij)Isoquinoline-1-Carboxylate
• Molecular Formula: C₂₇H₂₅N₃O₇S
• Molecular Weight: 535.57
• CAS Registry Number: 63149-14-4
• EINECS: 263-958-0
• SMILES: C1=CC(=C4C2=C1N(C(=O)C(=C2C3=CC=CC=C3C4=O)C(OCC)=O)C)NC5=C([S](O)(=O)=O)C=C(C=C5)C.N
• InChI: 1S/C27H22N2O7S.H3N/c1-4-36-27(32)24-21-15-7-5-6-8-16(15)25(30)22-18(11-12-19(23(21)22)29(3)26(24)31)28-17-10-9-14(2)13-20(17)37(33,34)35;/h5-13,28H,4H2,1-3H3,(H,33,34,35);1H3
• InChIKey: QVXNYPRHFHUQPZ-UHFFFAOYSA-N

Properties

• Boiling point: 783.4°C at 760 mmHg (Cal.)
• Flash point: 427.6°C (Cal.)