structure of 5-Bromo-3-methylpyrazin-2-ol

5-Bromo-3-methylpyrazin-2-ol

CAS No.: 100047-56-1
M. Wt: 189.01000
M. Fa: C5H5BrN2O
InChI Key: RNHAEGVBHQSLFS-UHFFFAOYSA-N
Appearance: Pale-yellow Solid

Names and Identifiers of 5-Bromo-3-methylpyrazin-2-ol

CAS Number

100047-56-1

MDL Number

MFCD22548397

IUPAC Name

5-bromo-3-methyl-1H-pyrazin-2-one

InChI

InChI=1S/C5H5BrN2O/c1-3-5(9)7-2-4(6)8-3/h2H,1H3,(H,7,9)

InChIKey

RNHAEGVBHQSLFS-UHFFFAOYSA-N

Canonical SMILES

CC1=NC(=CNC1=O)Br

UNSPSC Code

12352100

Physical and chemical properties of 5-Bromo-3-methylpyrazin-2-ol

Acidity coefficient

10.05±0.60(Predicted)

Density

1.84±0.1 g/cm3(Predicted)

Exact Mass

187.95900

LogP

0.84080

Molecular Formula

C5H5BrN2O

Molecular Weight

189.01000

PSA

45.75000

Storage condition

under inert gas (nitrogen or Argon) at 2-8°C

Safety Information of 5-Bromo-3-methylpyrazin-2-ol

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 5-Bromo-3-methylpyrazin-2-ol

5-Bromo-3-methylpyrazin-2-ol has several applications:

  • Organic Synthesis: It serves as a versatile building block for synthesizing more complex pyrazine derivatives and other organic compounds.
  • Pharmaceutical Development: Its unique structure makes it a candidate for developing new pharmaceuticals with potential therapeutic effects.
  • Dyes and Agrochemicals: The compound is also investigated for its utility in producing dyes and agrochemical products.

Physical sample testing spectrum (NMR) of 5-Bromo-3-methylpyrazin-2-ol

Physical sample testing spectrum (NMR) of 5-Bromo-3-methylpyrazin-2-ol

Retrosynthesis analysis of 5-Bromo-3-methylpyrazin-2-ol

  • Route#1

    Cas:19838-07-4
    Cas:100047-56-1