2-Methyl-5-nitropyrimidine-4,6-diol

Name: 2-Methyl-5-nitropyrimidine-4,6-diol
Brand: ChemScene
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CAS No. 53925-27-2
Cat. No. CS-0037967
Purity≥97%
MDL No.None

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Type	HazMat Fee
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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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2-Methyl-5-nitropyrimidine-4,6-diol|CS-0037967

Structure of 53925-27-2

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Description

2-Methyl-5-nitropyrimidine-4,6-diol features a fused heterocyclic core with strategically positioned nitro and hydroxyl groups, enabling direct incorporation into bioactive scaffolds. The electron-deficient pyrimidine ring enhances reactivity in nucleophilic substitution, while the ortho-hydroxyl arrangement promotes tautomerization and metal chelation. This bench-stable compound serves as a key intermediate for pharmaceuticals and agrochemicals requiring polar, nitrogen-rich motifs.

Application

2-Methyl-5-nitropyrimidine-4,6-diol serves as a versatile building block in heterocyclic synthesis, enabling efficient access to substituted pyrimidines via nucleophilic displacement or reduction. The ortho-diol functionality enhances solubility and facilitates downstream derivatization, while the nitro group provides a handle for reductive transformations. Bench-stable and compatible with standard purification methods, it functions effectively in medicinal chemistry campaigns targeting kinase inhibitors and antiviral scaffolds.

General Information

CAS No. 53925-27-2
Cat. No. CS-0037967
Purity ≥97%
MDL No. None
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅H₅N₃O₄
Molecular Weight 171.11
Synonym(s) 6-hydroxy-2-methyl-5-nitro-4(3H)-pyrimidinone
SMILES CC1=NC(=C(C(=N1)O)[N+](=O)[O-])O

Computational Chemistry Data

TPSA 109.38
LogP 0.10442
H_Acceptors 6
H_Donors 2
Rotatable_Bonds 1

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-P280-P302+P352

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Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Key Words

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2-Methyl-5-nitropyrimidine-4,6-diol

CAS No. 53925-27-2

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