2,6-Dihydroxypyridine-4-carboxylic acid - CAS 99-11-6
Catalog: |
BB042261 |
Product Name: |
2,6-Dihydroxypyridine-4-carboxylic acid |
CAS: |
99-11-6 |
Synonyms: |
2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid |
IUPAC Name: | 2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid |
Description: | 2,6-Dihydroxypyridine-4-carboxylic acid (CAS# 99-11-6) is a useful research chemical. |
Molecular Weight: | 155.11 |
Molecular Formula: | C6H5NO4 |
Canonical SMILES: | C1=C(C=C(NC1=O)O)C(=O)O |
InChI: | InChI=1S/C6H5NO4/c8-4-1-3(6(10)11)2-5(9)7-4/h1-2H,(H,10,11)(H2,7,8,9) |
InChI Key: | CSGQJHQYWJLPKY-UHFFFAOYSA-N |
Boiling Point: | 375.5 °C at 760 mmHg |
Melting Point: | >300 °C |
Purity: | 95 % |
Density: | 1.708 g/cm3 |
Appearance: | Yellow powder |
Storage: | Store in a cool, dry place. Keep container closed when not in use. |
MDL: | MFCD00006274 |
LogP: | 0.19100 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22608674 | 20120801 | Pyrimidin-2(1H)-ones based inhibitors of Mycobacterium tuberculosis orotate phosphoribosyltransferase | European journal of medicinal chemistry |
22726932 | 20120715 | Construction and functionalization of fused pyridine ring leading to novel compounds as potential antitubercular agents | Bioorganic & medicinal chemistry letters |
21410435 | 20110615 | Structural investigation of inhibitor designs targeting 3-dehydroquinate dehydratase from the shikimate pathway of Mycobacterium tuberculosis | The Biochemical journal |
17029947 | 20070701 | Spectral properties of some metal complexes derived from uracil-thiouracil and citrazinic acid compounds | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
16749811 | 20060609 | 6,6'-Dibromo-4,4'-di(hexoxymethyl)-2,2'- bipyridine: a new solubilizing building block for macromolecular and supramolecular applications | The Journal of organic chemistry |
Complexity: | 276 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.02185764 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.02185764 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 86.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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