基本情報
- CAS
376367-93-0- 標準SMILES
Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C(O)c1ccccn1.[Ir]- InChIKey
CTOBHCLNNFAQNN-UHFFFAOYSA-M- 分子式
- C28H17F4IrN3O2-2
- 平均分子量
- 695.7 g/mol
- 単同位体質量
- 696.08861
名称と識別子
- 優先名称
- Bis(2-(4,6-difluorophenyl)pyridinato-C2,N)(picolinato)iridium(III)
- IUPAC
- bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);iridium;pyridine-2-carboxylic acid
- 現地名
- FIRPIC [ビス(3,5-ジフルオロ-2-(2-ピリジルフェニル-(2-カルボキシピリジル)イリジウム(III)]
- 英語名
- Firpic
- 分子式
- C28H16F4IrN3O2
- 分子量
- 694.665
名称と別名
Bis[2-(4,6-difluorophenyl)pyridinato-C2,N](picolinato)iridium(III)Bis(2-(4,6-difluorophenyl)pyridinato-C2,N)(picolinato)iridium(III)RefChem:568671694-716-6376367-93-0FirpicBis(4,6-difluorophenylpyridinato-N,C2)picolinatoiridium2-(2,4-difluorobenzene-6-id-1-yl)pyridine;iridium;pyridine-2-carboxylic acidBis(3,5-difluoro-2-(2-pyridyl)-phenyl-(2-carboxypyridyl)-iridium(III)SCHEMBL29761635bis(3,5-difluoro-2-(pyridin-2-yl)phenyl)(picolinoyloxy)iridiumAC-33755
名称をさらに表示
FIRPIC [ビス(3,5-ジフルオロ-2-(2-ピリジルフェニル-(2-カルボキシピリジル)イリジウム(III)]Bis(4,6-difluorophenylpyridine)( picolinate) iridiuM(Ⅲ)FPicIrF2IrpicBis[2-(4,6-difLIraZolve-ER Blueinato)iridium(III))pyridinato-C2,N](picoL
Bis[2-(4,6-difluorophenyl)pyridinato-C2,N](picolinato)iridium(III), 97%Bis[3,5-difluoro-2-(2-pyridyl)phenyl] (2-carboxypyridyl) iridium (III)
物性
構造計算による物性
- 極性表面積
- 76 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 11
- 回転可能結合数
- 3
- 重原子数
- 38
- 形式電荷
- -2
- 複雑度
- 927
物理化学的性質
- 融点
- 330 · 330-335°C
- 貯蔵温度
- Sealed in dry,Room Temperature
- 外見
- powder
- 色
- Yellow
- InChI
- InChI=1S/2C11H6F2N.C6H5NO2.Ir/c2*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;8-6(9)5-3-1-2-4-7-5;/h2*1-4,6-7H;1-4H,(H,8,9);/q;;;+1/p-1
- InChIKey
- CTOBHCLNNFAQNN-UHFFFAOYSA-M
- SMILES
- [Ir](OC(=O)C1C=CC=CN=1)(C1C=C(F)C=C(F)C=1C1=CC=CC=N1)C1=CC(F)=CC(F)=C1C1C=CC=CN=1
- Absorption
- 256 nm · λmax256 nm (DCM)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
安全データ
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- ストレージクラス
- 11 - Combustible Solids
化学と産業
応用分野
説明Bis[2-(4,6-difluorophenyl)pyridinato-C2,N](picolinato)iridium, abbreviated as FIrPic, F2IrPic or Ir(difppy)2(pic), is one of the most investigated bis-cyclometallated iridium complexes in particular in the context of organic light emitting diodes (OLEDs). This is because of its attractive sky-blue emission, high emission efficiency, andsuitable energy levels as a phosphorescent dopant material.
使用FIrpic is a light blue heteroleptic triplet emitter.This material is typically doped into host matrices such as tetra-aryl silanes and short conjugation length carbazole derivatives in OLEDs; showing a good quantum efficiency.
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