1,3-Di(2-pyridyl)-1,3-propanedione

Name: 1,3-Di(2-pyridyl)-1,3-propanedione
Brand: ChemScene
Availability: InStock
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CAS No. 10198-89-7
Cat. No. CS-0095536
Purity≥95%
MDL No.MFCD01321157

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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1,3-Di(2-pyridyl)-1,3-propanedione|CS-0095536

Structure of 10198-89-7

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General Information

CAS No. 10198-89-7
Cat. No. CS-0095536
Purity ≥95%
MDL No. MFCD01321157
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₀N₂O₂
Molecular Weight 226.24
Synonym(s) Dipicolinoylmethane
SMILES O=C(C1=NC=CC=C1)CC(=O)C2=NC=CC=C2

Description

1,3-Di(2-pyridyl)-1,3-propanedione features two pyridyl groups flanking a diketone core, enabling strong chelation with transition metals. This structural motif enhances coordination versatility in catalytic systems and supramolecular assemblies. The compound exhibits bench-stable handling and solubility in common organic solvents, facilitating use in synthesis and materials design.

Application

1,3-Di(2-pyridyl)-1,3-propanedione serves as a versatile ligand scaffold in transition metal catalysis and a key building block for heterocyclic synthesis. Its dual pyridyl groups enable robust coordination to metals such as Cu(I), Ni(II), and Pd(0), facilitating catalyst formation in cross-coupling reactions. The molecule exhibits good bench stability and facilitates efficient purification via crystallization, making it well-suited for iterative synthetic workflows and the construction of bioactive scaffolds in medicinal chemistry.

Synthesis

Route1
- 1122-62-9
- In-stock
  
  2524-52-9
- ~70%
- In-stock
  
  10198-89-7
References
- Andrews, Philip C.; Deacon, Glen B.; Frank, Rene; Fraser, Benjamin H.; Junk, Peter C.; MacLellan, Jonathan G.; Massi, Miliano; Moubaraki, Boujemaa; Murray, Keith S.; Silberstein, Morry European Journal of Inorganic Chemistry, 2009 , # 6 p. 744 - 751
Route2
- 1122-62-9
- In-stock
  
  2459-07-6
- ~%
- In-stock
  
  10198-89-7
References
- Australian Journal of Chemistry, , vol. 51, # 5 p. 371 - 382

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 59.92
LogP 1.9323
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 4

Other Classifications

Catalysts and Ligands Ligands Other Oxygen Ligands Diketone Series Ligands

Catalysis Diketone Ligands

Material Science Polymer/Macromolecule Reagents Metal Organic Frameworks (MOF) Raw Materials Organic Linker Molecules

Material Science Organic-Inorganic Hybrid Materials Metal Organic Frameworks (MOF) Raw Materials Organic Linker Molecules

Key Words

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1,3-Di(2-pyridyl)-1,3-propanedione

CAS No. 10198-89-7

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