Reaction
ChemicalBook > CAS DataBase List > [Ir(dtbbpy)(ppy)2][PF6]

[Ir(dtbbpy)(ppy)2][PF6]

Reaction
Product Name
[Ir(dtbbpy)(ppy)2][PF6]
CAS No.
676525-77-2
Chemical Name
[Ir(dtbbpy)(ppy)2][PF6]
Synonyms
Ir(ppy)2(dtbbpy)PF6;[Ir(dtbbpy)(ppy);[Ir(dtbbpy)(ppy)2][PF6];-2,2'-bipyridine)bis[(2-pyridinyL;[Ir(dtbbpy)(ppy)2]PF6;[Ir(dtbbpy)(ppy)2]PF6[[Ir(dtbbpy)(ppy)2]PF6];[Ir(dtbbpy)(ppy)2]PF6, high-purity crystalline;Iridium(1+), [4,4'-bis(1,1-dimethylethyl)-2,2'-bipyridine-κN1,κN1']bis[2-(2-p...;(4,4'-Di-tert-butyl-2,2'-bipyridine)bis[(2-pyridinyl)phenyl]iridium(III) Hexafluorophosphate;(4,4'-Di-tert-butyl-2,2'-bipyridine)di[(2-pyridinyl-κN)phenyl-κC]iridium hexafluorophosphate
CBNumber
CB32750362
Molecular Formula
C40H40F6IrN4P
Formula Weight
913.97
MOL File
676525-77-2.mol
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[Ir(dtbbpy)(ppy)2][PF6] Property

storage temp. 
2-8°C
form 
crystal
color 
yellow
λmax
380nm(CH2Cl2)(lit.)
InChI
1S/C18H24N2.2C11H8N.F6P.Ir/c1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-7(2,3,4,5)6;/h7-12H,1-6H3;2*1-6,8-9H;;
InChIKey
VCIVELSSYHAWGC-UHFFFAOYSA-N
SMILES
[P+5]([F-])([F-])([F-])([F-])([F-])[F-].C(C1=CC=N2[Ir+3]34(N5=CC=CC=C5C5=CC=CC=[C-]35)(N3=CC=CC=C3C3=CC=CC=[C-]43)N3=CC=C(C(C)(C)C)C=C3C2=C1)(C)(C)C
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Safety

Risk Statements 
36/37/38
Safety Statements 
26
WGK Germany 
3
TSCA 
No
HS Code 
2843.90.0000
Storage Class
11 - Combustible Solids
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
747769
Product name
[Ir(dtbbpy)(ppy)2]PF6
Packaging
50mg
Price
$102.12
Updated
2025/07/31
Sigma-Aldrich
Product number
747769
Product name
[Ir(dtbbpy)(ppy)
Packaging
100mg
Price
$212
Updated
2025/07/31
TCI Chemical
Product number
D4887
Product name
(4,4'-Di-tert-butyl-2,2'-bipyridine)bis[(2-pyridinyl)phenyl]iridium(III) Hexafluorophosphate
Purity
>85.0%(HPLC)
Packaging
200mg
Price
$324
Updated
2025/07/31
Strem Chemicals
Product number
77-0410
Product name
(4,4'-Di-t-butyl-2,2'-bipyridine)bis[2-(2-pyridinyl-kN)phenyl-kC]iridium(III) hexafluorophosphate, 99%
Packaging
100mg
Price
$95
Updated
2024/03/01
Strem Chemicals
Product number
77-0410
Product name
(4,4'-Di-t-butyl-2,2'-bipyridine)bis[2-(2-pyridinyl-kN)phenyl-kC]iridium(III) hexafluorophosphate, 99%
Packaging
500mg
Price
$382
Updated
2024/03/01
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[Ir(dtbbpy)(ppy)2][PF6] Chemical Properties,Usage,Production

Reaction

  1. This Iridium catalyst is used in the synthesis of β-amidovinyl sulfones via visible-light photoredox catalysis.
  2. Numerous uses of this photoredox catalyst are reported

Uses

[Ir(dtbbpy)(ppy)2]PF6 is an iridium-based photocatalyst which is used to drive various photochemical reactions such as:

  • Coupling of N-arylamines and nitroalkanes via an oxidative aza-Henry reaction.
  • Atom transfer radical addition (ATRA) of haloalkanes to alkenes and alkynes.
  • Conversion of 2-bromoanilides to the corresponding 3,3-disubstituted oxindoles.
  • Aryl-alkyl CC reductive cross-coupling reactions.

reaction suitability

core: iridium
reaction type: Photocatalysis
reagent type: catalyst

Synthesis

Dichlorobridged dimer (0.1 mmol) was reacted with the appropriate neutral ligand (0.22 mmol) in ethylene glycol (5.0 mL) at reflux (150C) for 15 h with continuous stirring. After cooling to room temperature, the mixture was transferred to a dispensing funnel with water (3 x 30 mL) and washed (except in the case of C^N) dtbppy with ether (3 x 50 mL). The aqueous layer was heated to 70C for 5 min using a heat gun to remove residual organic solvent. The vessel was then placed on ice and 10 mL of aqueous ammonium hexafluorophosphate (1.0 g in 10 mL of deionized water) was slowly added to the reaction mixture to obtain a colored suspension. The precipitate was collected by suction filtration and allowed to air dry overnight. The product was recrystallized by acetonitrile:ether vapor diffusion (except for C^N) dtbppy, where hexane:acetone vapor diffusion was used) and dried under vacuum (100C) for 24 hr to give the pure product (4,4'-di-tert-butyl-2,2'-bipyridine)bis[(2-pyridyl)phenyl]iridium(III) hexafluorophosphate (yield: 68- 80%).

[Ir(dtbbpy)(ppy)2][PF6] Preparation Products And Raw materials

Raw materials

Preparation Products

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[Ir(dtbbpy)(ppy)2][PF6] Suppliers

Yunnan Precious Metals Laboratory Co., Ltd
Tel
871-15559856 15559856215
Fax
0871-68329797
Email
yujuan@ipm.com.cn
Country
China
ProdList
225
Advantage
58
Shengyang Runze (Beijing) Technology Co.,
Tel
010-010-57302162 17611011830
Email
lyt001@syrz01.com
Country
China
ProdList
169
Advantage
58
Jiangsu Boquan Biotechnology Co., Ltd.
Tel
19025100081
Email
5954981@qq.com
Country
China
ProdList
2037
Advantage
58
Guiyan Chemical Materials (Yunnan) Co., LTD
Tel
18317061306
Email
wanghongyou@ipm.com.cn
Country
China
ProdList
114
Advantage
58
Shanghai Jiahua Herong Biotechnology Co., Ltd
Tel
18916155073
Email
market@trustwe.com
Country
China
ProdList
195
Advantage
58
TCI (Shanghai) Development Co., Ltd.
Tel
021-67121386
Fax
021-67121385
Email
Sales-CN@TCIchemicals.com
Country
China
ProdList
24529
Advantage
81
Beijing HwrkChemical Technology Co., Ltd
Tel
010-89508211 18501085097
Fax
010-89508210
Email
sales.bj@hwrkchemical.com
Country
China
ProdList
9411
Advantage
55
Energy Chemical
Tel
021-021-58432009 400-005-6266
Fax
021-58436166
Email
sales8178@energy-chemical.com
Country
China
ProdList
44802
Advantage
61
Chengdu Forest Science and Technology Development Co., Ltd.
Tel
18030648795 18030648795
Fax
028-61777050
Email
sales@cdforestchem.com
Country
China
ProdList
2000
Advantage
58
TOKYO CHEMICAL INDUSTRY CO., LTD.
Tel
03-36680489
Fax
03-3668-0520
Email
Sales-JP@TCIchemicals.com
Country
Japan
ProdList
28387
Advantage
80
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View Lastest Price from [Ir(dtbbpy)(ppy)2][PF6] manufacturers

Zhejiang Free Trade Zone Violet Trade Co., Ltd.
Product
[Ir(ppy)2(dtbbpy)] PF6 676525-77-2
Price
US $0.00/g
Min. Order
1g
Purity
99.90%
Supply Ability
100kgs
Release date
2021-09-16
Xian confluore Biological Technology Co., Ltd.
Product
Ir(ppy)2(dtbbpy)PF6 676525-77-2
Price
US $0.00/g
Min. Order
5g
Purity
>95.00%
Supply Ability
5g
Release date
2024-03-30
Career Henan Chemical Co
Product
[Ir(dtbbpy)(ppy)2][PF6] 676525-77-2
Price
US $1.00/kg
Min. Order
1kg
Purity
95%-99%
Supply Ability
10kg
Release date
2018-12-18

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