4-Oxo-1,4-dihydropyridine-2,6-dicarboxylic acid hydrate

Base Information

• Chemical Name: 4-Oxo-1,4-dihydropyridine-2,6-dicarboxylic acid hydrate
• CAS No.: 199926-39-1
• Molecular Formula: C₇H₅NO₅*H₂O
• Molecular Weight: 201.136
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID60486644
• Mol file: 199926-39-1.mol

Synonyms:199926-39-1;4-Oxo-1,4-dihydropyridine-2,6-dicarboxylic acid hydrate;chelidamic acid monohydrate;4-Oxo-1H-pyridine-2,6-dicarboxylic acid;hydrate;Chelidamic acid hydrate;4-HYDROXYPYRIDINE-2,6-DICARBOXYLIC ACID HYDRATE;2,6-Pyridinedicarboxylic acid, 1,4-dihydro-4-oxo-, hydrate (1:1);1961195-81-2;SCHEMBL113302;Chelidamic acid monohydrate,98;DTXSID60486644;MFCD00150943;MFCD03818117;AKOS015998637;CHELIDAMIC ACID MONOHYDRATE, 98;AS-50193;Chelidamic acid hydrate, >=95%, powder;SY233437;CS-0062895;EN300-207708;O11277;A879902;4-hydroxypyridine-2,6-dicarboxylic acid monohydrate;4-Oxo-1,4-dihydropyridine-2,6-dicarboxylic acid monohydrate;Chelidamic acid hydrate, >=97.0% (dried material, T), ~1 mol/mol water

Chemical Property of 4-Oxo-1,4-dihydropyridine-2,6-dicarboxylic acid hydrate

Chemical Property:

• Melting Point: 263°C
• PSA: 116.69000
• LogP: -0.29300
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 201.02733694
• Heavy Atom Count: 14
• Complexity: 320

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Oxo-1,4-dihydropyridine-2,6-dicarboxylicAcidHydrate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(NC(=CC1=O)C(=O)O)C(=O)O.O