6-Methyl-5-oxo-4,5-dihydropyrazine-2-carboxylic acid

Base Information

• Chemical Name: 6-Methyl-5-oxo-4,5-dihydropyrazine-2-carboxylic acid
• CAS No.: 77168-83-3
• Molecular Formula: C₆H₆N₂O₃
• Molecular Weight: 154.125
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID60504554
• Wikidata: Q72465597
• Mol file: 77168-83-3.mol

Synonyms:77168-83-3;6-Methyl-5-oxo-4,5-dihydropyrazine-2-carboxylic acid;6-Methyl-5-oxo-4,5-dihydro-pyrazine-2-carboxylic acid;5-HYDROXY-6-METHYLPYRAZINE-2-CARBOXYLIC ACID;5-methyl-6-oxo-1H-pyrazine-3-carboxylic acid;SCHEMBL22439859;SCHEMBL26672964;DTXSID60504554;BCP22300;CDA16883;MFCD15144367;AKOS015999452;SB38689;AC-24735;AM807131;AS-37176;CS-0187231;FT-0757131;A865332;5-Hydroxy-6-methylpyrazine-2-carboxylic acid;4,5-Dihydro-6-methyl-5-oxo-2-pyrazinecarboxylic acid

Chemical Property of 6-Methyl-5-oxo-4,5-dihydropyrazine-2-carboxylic acid

Chemical Property:

• Melting Point: >300℃
• Boiling Point: 567.799 °C at 760 mmHg
• PKA: 6.21±0.20(Predicted)
• Flash Point: 297.194 °C
• PSA: 83.05000
• Density: 1.495 g/cm³
• LogP: -0.22350
• Storage Temp.: 2-8°C
• XLogP3: -1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 154.03784206
• Heavy Atom Count: 11
• Complexity: 278

Purity/Quality:

98%min ^*data from raw suppliers

6-Methyl-5-oxo-4,5-dihydropyrazine-2-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CNC1=O)C(=O)O