1-(4-Bromo-2-pyridinyl)ethanone

Name: 1-(4-Bromo-2-pyridinyl)ethanone
Brand: ChemScene
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CAS No. 1060805-69-7
Cat. No. CS-0032322
Molecule weight200.03
Purity≥97%
MDL No.MFCD13189212

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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-(4-Bromo-2-pyridinyl)ethanone|CS-0032322

Structure of 1060805-69-7

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General Information

CAS No. 1060805-69-7
Cat. No. CS-0032322
Purity ≥97%
MDL No. MFCD13189212
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆BrNO
Molecular Weight 200.03
Synonym(s) 1-(4-Bromopyridin-2-yl)ethanone
SMILES CC(C1=CC(Br)=CC=N1)=O

Description

1-(4-Bromo-2-pyridinyl)ethanone features a brominated pyridine ring coupled to an acetyl group, delivering a robust scaffold for cross-coupling reactions. The electron-deficient heterocycle enables efficient palladium-catalyzed transformations, while the ketone functionality offers direct handle for nucleophilic additions. This compound serves as a key intermediate in medicinal chemistry and materials synthesis, combining synthetic versatility with predictable reactivity under standard conditions.

Application

1-(4-Bromo-2-pyridinyl)ethanone serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions due to its well-defined halogen functionality. The pyridine core provides strong coordination for transition metals, while the acetyl group offers a handle for further functionalization via enolization or nucleophilic substitution. Bench-stable and readily purified by crystallization, it facilitates efficient synthesis of heterocyclic scaffolds and API intermediates.

Synthesis

Route1
- In-stock
  
  58530-53-3
- In-stock
  
  78191-00-1
- ~67%
- In-stock
  
  1060805-69-7
References
- Shionogi and Co., Ltd.; TADA, Yukio; KUSAKABE, Ken-ichi; TADANO, Genta Patent: EP2703401 A1, 2014 ; Location in patent: Paragraph 0219 ;

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-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 29.96
LogP 2.0467
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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1-(4-Bromo-2-pyridinyl)ethanone

CAS No. 1060805-69-7

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