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CS-W001157 4
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5-Bromo-2-methylpyrimidin-4-ol

  • CAS No. 1676-57-9

  • Cat. No. CS-W005968
  • Molecule weight189.01
  • Purity≥96%
  • MDL No.MFCD08460358

*For research and further manufacturing use only, not for direct human use.

5-Bromo-2-methylpyrimidin-4-ol|CS-W005968

Structure of 1676-57-9

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General Information

  • CAS No. 1676-57-9
  • Cat. No. CS-W005968
  • Purity ≥96%
  • MDL No. MFCD08460358
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₅BrN₂O
  • Molecular Weight 189.01
  • Synonym(s) 5-BROMO-2-METHYL-4(1H)-PYRIMIDINONE
  • SMILES OC1=NC(C)=NC=C1Br

Description

5-Bromo-2-methylpyrimidin-4-ol features a pyrimidine core bearing bromo and hydroxyl groups at C5 and C4, respectively, with a methyl substituent at C2. This electron-deficient scaffold enables direct coupling in cross-coupling reactions and serves as a key building block in medicinal chemistry and agrochemical synthesis.

Application

5-Bromo-2-methylpyrimidin-4-ol serves as a versatile building block in medicinal chemistry, enabling efficient construction of pyrimidine-based scaffolds. The bromo group facilitates palladium-catalyzed cross-coupling reactions, while the hydroxyl and methyl functionalities provide sites for further functionalization. Its bench-stable nature and compatibility with standard synthetic protocols make it ideal for modular library synthesis and API development.

Synthesis

  • Route1

    References

    • Yakugaku Zasshi, , vol. 63, p. 25,27 Chem.Abstr., , p. 609

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   46.01
  • LogP   1.25312
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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