5-Fluoro-6-hydroxypyridine-3-carboxylic acid - CAS 1526-16-5
Catalog: |
BB064521 |
Product Name: |
5-Fluoro-6-hydroxypyridine-3-carboxylic acid |
CAS: |
1526-16-5 |
Synonyms: |
5-Fluoro-6-hydroxy- (6CI,8CI)-nicotinic acid; 5-Fluoro-1,6-dihydro-6-oxo-3-pyridinecarboxylic acid; 5-Fluoro-6-hydroxynicotinic acid |
IUPAC Name: | 5-fluoro-6-oxo-1H-pyridine-3-carboxylic acid |
Description: | 5-Fluoro-6-hydroxypyridine-3-carboxylic acid is a building block of Favipiravir (F103350). Favipiravir is used for the treatment of advanced Ebola virus infection in a small animal models. |
Molecular Weight: | 157.1 |
Molecular Formula: | C6H4FNO3 |
Canonical SMILES: | C1=C(C(=O)NC=C1C(=O)O)F |
InChI: | InChI=1S/C6H4FNO3/c7-4-1-3(6(10)11)2-8-5(4)9/h1-2H,(H,8,9)(H,10,11) |
InChI Key: | IEXXBKVOINSOFC-UHFFFAOYSA-N |
References: | Oestereich, L., et al. Antiviral Res., 105, 17 (2014); Baranovich, T., et al. J. Virol. 87, 3741 (2013); Chem. and Eng. News p.8, Dec. 1 (2014). |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 280 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.01752115 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.01752115 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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