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4,4-Difluoro-1-phenyl-1,3-butanedione, also known as DPBD, is an organic compound that serves as a versatile ligand in the formation of metal complexes. It is characterized by the presence of a 1,3-butanedione backbone with a phenyl group and two fluorine atoms attached to the 4,4-positions. This unique structure endows DPBD with the ability to chelate various metal ions, making it a valuable component in the development of metal complexes with diverse applications.

62679-61-2

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62679-61-2 Usage

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Used in Coordination Chemistry:
4,4-Difluoro-1-phenyl-1,3-butanedione is used as a ligand for the formation of metal complexes, which are essential in coordination chemistry. The metal complexes formed with DPBD include:
Eu(DPBD)3·H2O: A europium complex with a water molecule coordinated to the metal center.
Eu(DPBD)3·biq (biq = 2,2-biquinoline): A europium complex with biquinolines as ancillary ligands.
Eu(DPBD)3·phen (phen = 1,10-phenanthroline): A europium complex with phenanthroline ligands, which can enhance the luminescent properties of the complex.
Eu(DPBD)3·neo (neo = neocuproine): A europium complex with neocuproine ligands, which can improve the stability and solubility of the complex.
Eu(DPBD)3·bipy (bipy = 2,2-bipyridyl): A europium complex with bipyridyl ligands, which can modulate the electronic properties of the complex.
Gd(DPBD)3·(H2O)2: A gadolinium complex with two water molecules coordinated to the metal center, which can be used in magnetic resonance imaging (MRI) contrast agents.
These metal complexes have potential applications in various fields, such as luminescent materials, catalysts, and medical imaging. The use of DPBD as a ligand allows for the fine-tuning of the properties of these metal complexes, making them suitable for specific applications.

Check Digit Verification of cas no

The CAS Registry Mumber 62679-61-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,2,6,7 and 9 respectively; the second part has 2 digits, 6 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 62679-61:
(7*6)+(6*2)+(5*6)+(4*7)+(3*9)+(2*6)+(1*1)=152
152 % 10 = 2
So 62679-61-2 is a valid CAS Registry Number.
InChI:InChI=1/C10H8F2O2/c11-10(12)9(14)6-8(13)7-4-2-1-3-5-7/h1-5,10H,6H2

62679-61-2 Well-known Company Product Price

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  • Aldrich

  • (533092)  4,4-Difluoro-1-phenyl-1,3-butanedione  97%

  • 62679-61-2

  • 533092-10G

  • 2,139.93CNY

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62679-61-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4,4-difluoro-1-phenylbutane-1,3-dione

1.2 Other means of identification

Product number -
Other names TOS-BB-1273

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

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More Details:62679-61-2 SDS

62679-61-2Relevant academic research and scientific papers

Synthesis, Photoluminescence Behavior of Green Light Emitting Tb(III) Complexes and Mechanistic Investigation of Energy Transfer Process

Bala, Manju,Kumar, Satish,Devi, Rekha,Khatkar, Avni,Taxak,Boora, Priti,Khatkar

, p. 775 - 784 (2018)

A series of five new terbium(III) ion complexes with 4,4-difluoro-1-phenylbutane-1,3-dione (HDPBD) and anciliary ligands was synthesized. The composition and properties of complexes were analyzed by elemental analysis, IR, NMR, powder X-ray diffaraction,

Synthesis, photoluminescent features and intramolecular energy transfer mechanism of europium (III) complexes with fluorinate β-diketone ligand and auxiliary ligands

Bala, Manju,Kumar, Satish,Taxak,Boora, Priti,Khatkar

, p. 6 - 13 (2015)

Abstract A series of novel luminescent europium (III) complexes based on fluorinated β-diketone ligand 4,4-difluoro-1-phenyl-1,3-butanedione (DPBD) and auxiliary ligands 2,2-biquinoline (biq) or 1,10-phenanthroline (phen) or neocuproine (neo) or 2,2-bipyr

Discovery of a potent, selective and orally active canine COX-2 inhibitor, 2-(3-difluoromethyl-5-phenyl-pyrazol-1-yl)-5-methanesulfonyl-pyridine

Li, Jin,Lundy DeMello, Kristin M.,Cheng, Henry,Sakya, Subas M.,Bronk, Brian S.,Rafka, Robert J.,Jaynes, Burton H.,Ziegler, Carl B.,Kilroy, Carolyn,Mann, Donald W.,Nimz, Eric L.,Lynch, Michael P.,Haven, Michelle L.,Kolosko, Nicole L.,Minich, Martha L.,Li, Chao,Dutra, Jason K.,Rast, Bryson,Crosson, Rhonda M.,Morton, Barry J.,Kirk, Glen W.,Callaghan, Kathleen M.,Koss, David A.,Shavnya, Andrei,Lund, Lisa A.,Seibel, Scott B.,Petras, Carol F.,Silvia, Annette

, p. 95 - 98 (2007/10/03)

Structure-activity relationship (SAR) studies of 2-[3-di(and tri)fluoromethyl-5-arylpyrazol-1-yl]-5-methanesulfonylpyridine derivatives for canine COX enzymes are described. This led to the identification of 12a as a lead candidate for further progression. The in vitro and in vivo activity of 12a for the canine COX-2 enzyme as well as its in vivo efficacy and pharmacokinetic properties in dog are highlighted.

Synthesis and biological evaluation of the 1,5-diarylpyrazole class of cyclooxygenase-2 inhibitors: Identification of 4-[5-(4-methylphenyl)- 3(trifluoromethyl)-1h-pyrazol-1-yl]benzenesulfonamide (sc-58635, celecoxib)

Penning, Thomas D.,Talley, John J.,Bertenshaw, Stephen R.,Carter, Jeffery S.,Collins, Paul W.,Docter, Stephen,Graneto, Matthew J.,Lee, Len F.,Malecha, James W.,Miyashiro, Julie M.,Rogers, Roland S.,Rogier,Yu, Stella S.,Anderson, Gary D.,Burton, Earl G.,Cogburn, J. Nita,Gregory, Susan A.,Koboldt, Carol M.,Perkins, William E.,Seibert, Karen,Veenhuizen, Amy W.,Zhang, Yan Y.,Isakson, Peter C.

, p. 1347 - 1365 (2007/10/03)

A series of sulfonamide-containing 1,5-diarylpyrazole derivatives were prepared and evaluated for their ability to block cyclooxygenase-2 (COX-2) in vitro and in vivo. Extensive structure-activity relationship (SAR) work was carried out within this series, and a number of potent and selective inhibitors of COX-2 were identified. Since an early structural lead (1f, SC- 236) exhibited an unacceptably long plasma half-life, a number of pyrazole analogs containing potential metabolic sites were evaluated further in vivo in an effort to identify compounds with acceptable pharmacokinetic profiles. This work led to the identification of 1i (4-[5-(4-methylphenyl)-3- (trifluoromethyl)-1H-pyrazol-1-y1]benzenesulfonamide, SC-58635, celecoxib), which is currently in phase III clinical trials for the treatment of rheumatoid arthritis and osteoarthritis.

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