2-Hydroxy-4-methyl-6-oxo-1,6-dihydropyridine-3-sulfonic acid

Base Information

• Chemical Name: 2-Hydroxy-4-methyl-6-oxo-1,6-dihydropyridine-3-sulfonic acid
• CAS No.: 37678-74-3
• Molecular Formula: C6H7NO5S
• Molecular Weight: 205.18800
• DSSTox Substance ID: DTXSID00601490
• Mol file: 37678-74-3.mol

Synonyms:37678-74-3;SCHEMBL8761974;DTXSID00601490;2-Hydroxy-4-methyl-6-oxo-1,6-dihydropyridine-3-sulfonic acid

Chemical Property of 2-Hydroxy-4-methyl-6-oxo-1,6-dihydropyridine-3-sulfonic acid

Chemical Property:

• PSA: 116.10000
• Density: 1.77±0.1 g/cm3(Predicted)
• LogP: 1.12870
• XLogP3: -1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 205.00449350
• Heavy Atom Count: 13
• Complexity: 411

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)NC(=C1S(=O)(=O)O)O

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