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| CAS No.: | 337526-85-9 |
|---|---|
| Name: | Acetylacetonatobis(2-phenylpyridine)iridium |
| Molecular Structure: | |
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| Formula: | C27H23IrN2O2 |
| Molecular Weight: | 599.712 |
| Synonyms: | Iridium,(2,4-pentanedionato-kO,kO')bis[2-(2-pyridinyl-kN)phenyl-kC]-, (OC-6-33)- (9CI);Acetylacetonatobis[2-(2-pyridyl)phenyl]iridium;Ir(ppy)2(acac); |
| EINECS: | 803-559-6 |
| Melting Point: | 349-356°C |
| Hazard Symbols: | Xi |
| Risk Codes: | 36/37/38 |
| Safety: | 26 |
| PSA: | 52.08000 |
| LogP: | 6.05770 |
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Specification
The Acetylacetonatobis(2-phenylpyridine)iridium, with the CAS registry number 337526-85-9, is also known as Ir(ppy)2(acac), Acetylacetonatobis(2-phenylpyridine)iridium. It belongs to the product categories of Oled Materials; Fine Chemicals, Specialty Chemicals, Intermediates, Electronic Chemical, Organic Synthesis, Functional Materials. This chemical's molecular formula is C27H23IrN2O2 and molecular weight is 599.71. What's more, both its IUPAC name and systematic name are the same which is called Bis(2-phenylpyridine)(acetylacetonate)iridium(III).
Physical properties about Acetylacetonatobis(2-phenylpyridine)iridium are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 7; (4)Polar Surface Area: 52.08 Å2.
You can still convert the following datas into molecular structure:
(1) SMILES: C/C(=C/C(=O)C)/O[Ir](c1ccccc1c2ccccn2)c3ccccc3c4ccccn4
(2) InChI: InChI=1S/2C11H8N.C5H8O2.Ir/c2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-4(6)3-5(2)7;/h2*1-6,8-9H;3,6H,1-2H3;/q;;;+1/p-1/b;;4-3-;
(3) InChIKey: QISLNNOQKUEVTI-DVACKJPTSA-M