1-[3,10-Dihydroxy-12-(2-Hydroxypropyl)-2,6,7,11-Tetramethoxy-4,9-Dioxoperylen-1-Yl]Propan-2-Yl Benzoate
[CAS# 124824-06-2]

Identification

• Name: 1-[3,10-Dihydroxy-12-(2-Hydroxypropyl)-2,6,7,11-Tetramethoxy-4,9-Dioxoperylen-1-Yl]Propan-2-Yl Benzoate
• Synonyms: [2-[3,10-Dihydroxy-12-(2-Hydroxypropyl)-2,6,7,11-Tetramethoxy-4,9-Dioxo-Perylen-1-Yl]-1-Methyl-Ethyl] Benzoate; Benzoic Acid [2-[3,10-Dihydroxy-12-(2-Hydroxypropyl)-2,6,7,11-Tetramethoxy-4,9-Dioxo-1-Perylenyl]-1-Methylethyl] Ester; Benzoic Acid [2-[3,10-Dihydroxy-12-(2-Hydroxypropyl)-4,9-Diketo-2,6,7,11-Tetramethoxy-Perylen-1-Yl]-1-Methyl-Ethyl] Ester
• Molecular Formula: C₃₇H₃₄O₁₁
• Molecular Weight: 654.67
• CAS Registry Number: 124824-06-2
• SMILES: C6=C(C(OC(CC3=C2C1=C(CC(O)C)C(=C(O)C5=C1C(=C4C2=C(C(=C3OC)O)C(=O)C=C4OC)C(=CC5=O)OC)OC)C)=O)C=CC=C6
• InChI: 1S/C37H34O11/c1-16(38)12-19-25-26-20(13-17(2)48-37(43)18-10-8-7-9-11-18)36(47-6)34(42)28-22(40)15-24(45-4)30(32(26)28)29-23(44-3)14-21(39)27(31(25)29)33(41)35(19)46-5/h7-11,14-17,38,41-42H,12-13H2,1-6H3
• InChIKey: ZZTKVBAAURVMGM-UHFFFAOYSA-N

Properties

• Density: 1.456g/cm³ (Cal.)
• Boiling point: 933.625°C at 760 mmHg (Cal.)
• Flash point: 296.57°C (Cal.)