4,11-Diamino-2-(3-Propoxypropyl)-1H-Naphth[2,3-f]Isoindole-1,3,5,10(2H)-Tetrone
[CAS# 71617-29-3]

Identification

• Name: 4,11-Diamino-2-(3-Propoxypropyl)-1H-Naphth[2,3-f]Isoindole-1,3,5,10(2H)-Tetrone
• Synonyms: (5As,9As)-4,11-Diamino-2-(3-Propoxypropyl)-5A,9A-Dihydronaphtho[3,2-F]Isoindole-1,3,5,10-Diquinone; 1H-Naphth(2,3-F)Isoindole-1,3,5,10(2H)-Tetrone, 4,11-Diamino-2-(3-Propoxypropyl)-
• Molecular Formula: C₂₂H₂₃N₃O₅
• Molecular Weight: 409.44
• CAS Registry Number: 71617-29-3
• SMILES: [C@@H]34C(C1=C(C(=C2C(=C1N)C(N(C2=O)CCCOCCC)=O)N)C([C@H]3C=CC=C4)=O)=O
• InChI: 1S/C22H23N3O5/c1-2-9-30-10-5-8-25-21(28)15-16(22(25)29)18(24)14-13(17(15)23)19(26)11-6-3-4-7-12(11)20(14)27/h3-4,6-7,11-12H,2,5,8-10,23-24H2,1H3/t11-,12-/m0/s1
• InChIKey: KJSCNPYSVGHTMA-RYUDHWBXSA-N

Properties

• Density: 1.386g/cm³ (Cal.)
• Boiling point: 687.484°C at 760 mmHg (Cal.)
• Flash point: 369.577°C (Cal.)