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| IUPAC Name: | 4-[3,6,8-tris(4-carboxyphenyl)pyren-1-yl]benzoic acid |
| Description: | 1,3,6,8-Tetra(4'-carboxyphenyl)pyrene is a synthetic compound used in the synthesis of metal organic frameworks such as NU-1000. |
| Molecular Weight: | 682.67 |
| Molecular Formula: | C44H26O8 |
| Canonical SMILES: | C1=CC(=CC=C1C2=CC(=C3C=CC4=C(C=C(C5=C4C3=C2C=C5)C6=CC=C(C=C6)C(=O)O)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C(=O)O)C(=O)O |
| InChI: | InChI=1S/C44H26O8/c45-41(46)27-9-1-23(2-10-27)35-21-36(24-3-11-28(12-4-24)42(47)48)32-19-20-34-38(26-7-15-30(16-8-26)44(51)52)22-37(25-5-13-29(14-6-25)43(49)50)33-18-17-31(35)39(32)40(33)34/h1-22H,(H,45,46)(H,47,48)(H,49,50)(H,51,52) |
| InChI Key: | HVCDAMXLLUJLQZ-UHFFFAOYSA-N |
| Melting Point: | >235°C (dec.) |
| Solubility: | DMSO (Slightly) |
| Appearance: | Light Yellow to Dark Yellow Solid |
| Storage: | 4°C, Inert atmosphere, Light sensitive |
| References: | Kim, I., et al. Chem. Mater., 27, 4772 (2015); Kung, C., et al. ACS Appl. Mater. Interfaces (2015). |
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