6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione

Name: 6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 4956-05-2
Cat. No. CS-W008459
Purity≥98%
MDL No.MFCD00154757

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione|CS-W008459

Structure of 4956-05-2

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General Information

CAS No. 4956-05-2
Cat. No. CS-W008459
Purity ≥98%
MDL No. MFCD00154757
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₃H₂BrN₃O₂
Molecular Weight 191.97
Synonym(s) 5-Bromo-6-azauracil
SMILES O=C1NC(C(Br)=NN1)=O

Description

6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione is a bench-stable, electron-deficient triazine scaffold featuring a bromine substituent at the 6-position. This functional group enables direct incorporation into cross-coupling reactions, serving as a key building block for heterocyclic synthesis. The dione functionality enhances reactivity in nucleophilic substitution processes and supports integration into pharmaceutical intermediates and agrochemical frameworks.

Application

6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione serves as a versatile building block in heterocyclic synthesis, enabling efficient access to substituted triazine scaffolds. The bromo group facilitates palladium-catalyzed cross-coupling reactions, while the diketone functionality supports nucleophilic addition and condensation processes. This compound exhibits excellent bench stability and compatibility with diverse functional groups, making it well-suited for iterative synthesis strategies in medicinal chemistry and materials science applications.

Synthesis

Route1
- In-stock
  
  461-89-2
- ~91%
- In-stock
  
  4956-05-2
References
- PIERRE FABRE MEDICAMENT Patent: WO2005/80354 A1, 2005 ; Location in patent: Page/Page column 19 ; WO 2005/080354 A1

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 78.61
LogP -0.7793
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Key Words

6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione sigma6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione manufacturer6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione price6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione structure6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione SDSbuy 6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione supplier6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione uses6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione molecular weightprice of 6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione chemical name formula of 6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione

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6-Bromo-1,2,4-triazine-3,5(2H,4H)-dione

CAS No. 4956-05-2

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