3-Furoic acid
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| Category | Others |
| Catalog number | BBF-03885 |
| CAS | 488-93-7 |
| Molecular Weight | 112.08 |
| Molecular Formula | C5H4O3 |
| Purity | 98 % |
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Description
Furan-3-carboxylic acid is produced from Corynebacterium. Furan-3-carboxylic acid exhibits hypolipidemic activity in rodents. It lowers serum cholesterol and serum triglyceride levels in mice and rats.
Specification
| Synonyms | 3-Furancarboxylic acid; 3-Furanoic acid; 3-Carboxyfuran; NSC 349941 |
| Storage | Store at -20 ℃ |
| IUPAC Name | furan-3-carboxylic acid |
| Canonical SMILES | C1=COC=C1C(=O)O |
| InChI | InChI=1S/C5H4O3/c6-5(7)4-1-2-8-3-4/h1-3H,(H,6,7) |
| InChI Key | IHCCAYCGZOLTEU-UHFFFAOYSA-N |
Properties
| Appearance | White to off-white solid |
| Boiling Point | 229.6 ℃ at 760 mmHg |
| Melting Point | 120-122 ℃ |
| Density | 1.322 g/cm3 |
| Solubility | Soluble in DMSO (Slightly), Methanol (Slightly) |
| LogP | 1.03 |
Reference Reading
1.[Stability and detection of metabolites of barbiturates: 2-oxo tetrahydro-3-furoic acids].
Cavé C, Lafont O, Miocque M. Ann Pharm Fr. 1988;46(2):111-9.
2.Micellar electrokinetic chromatography method for the simultaneous determination of furanic compounds in honey and vegetable oils.
Foo Wong Y1, Makahleh A, Al Azzam KM, Yahaya N, Saad B, Sulaiman SA. Talanta. 2012 Aug 15;97:23-31. doi: 10.1016/j.talanta.2012.03.056. Epub 2012 Apr 27.
A simple micellar electrokinetic chromatography (MEKC) method for the simultaneous determination of 2-furfural (2-F), 3-furfural (3-F), 5-methylfurfural (5-MF), 5-hydroxymethylfurfural (5-HMF), 2-furoic acid (2-FA) and 3-furoic acid (3-FA) in honey and vegetable oils is described. Parameters affecting the separation such as pH, buffer and surfactant concentrations, applied voltage, capillary temperature, injection time and capillary length were studied and optimized. The separation was carried out in normal polarity mode at 20 °C, 22 kV and using hydrodynamic injection (17 s). The separation was achieved in a bare fused-silica capillary (46 cm × 50 μm i.d.) with a background electrolyte of 75 mM phosphoric acid (pH 7.3), containing 200 mM of sodium dodecyl sulphate (SDS). The detection wavelengths were at 200 nm (2-FA and 3-FA) and 280 nm (2-F, 3-F, 5-MF, 5-HMF). The furfurals were well separated in less than 20 min. The method was validated in terms of linearity, limit of detection and quantitation, precision and recoveries.
3.Hetaryleneaminopolyols and hetarylenecarbopeptoids: a new type of glyco- and peptidomimetics. Syntheses and studies on solution conformation and dynamics.
Moreno-Vargas AJ1, Jiménez-Barbero J, Robina I. J Org Chem. 2003 May 30;68(11):4138-50.
Ready access to a new class of oligomers has been demonstrated by the synthesis of hetaryleneaminopolyols and hetarylenecarbopeptoids using 3-hydroxymethyl-5-(4-amino-4-deoxy-d-arabinotetritol-1-yl)-2-methylfuran and 5-(4-amino-4-deoxy-d-arabinotetritol-1-yl)-2-methyl-3-furoic acid as novel scaffolds. The conformational behavior of peptidomimetics 22, 23, 25, 26, and 36 have been analyzed by NMR spectroscopy and extensive molecular dynamics simulations. MD simulations using the GB/SA continuum solvent model for water and the MM3 force field provide a population distribution of conformers which satisfactorily agrees with the experimental NMR data for the torsional degrees of freedom of the molecule.
4.Anticancer activity of dinuclear gallium(III) carboxylate complexes.
Kaluderović MR1, Gómez-Ruiz S, Gallego B, Hey-Hawkins E, Paschke R, Kaluderović GN. Eur J Med Chem. 2010 Feb;45(2):519-25. doi: 10.1016/j.ejmech.2009.10.038. Epub 2009 Oct 31.
The reaction of 3-methoxyphenylacetic acid, 4-methoxyphenylacetic acid, mesitylthioacetic acid, 2,5-dimethyl-3-furoic acid and 1,4-benzodioxane-6-carboxylic acid with trimethylgallium (1:1) yielded the dimeric complexes [Me(2)Ga(micro-O(2)CCH(2)C(6)H(4)-3-OMe)](2) (1), [Me(2)Ga(micro-O(2)CCH(2)C(6)H(4)-4-OMe)](2) (2), [Me(2)Ga(micro-O(2)CCH(2)SMes)](2) (3) (Mes=2,4,6-Me(3)C(6)H(2)), [Me(2)Ga{micro-O(2)C(Fur)}](2) (4) (Fur=2,5-dimethylfuran) and [Me(2)Ga{micro-O(2)C(Bdo)}](2) (5) (Bdo=1,4-benzodioxane) respectively. The molecular structure of 5 was determined by X-ray diffraction studies. The cytotoxic activity of the gallium(III) complexes (1-5) was tested against human tumor cell lines 8505C anaplastic thyroid cancer, A253 head and neck tumor, A549 lung carcinoma, A2780 ovarian cancer, DLD-1 colon carcinoma and compared with that of cisplatin. Taking into account the standard deviation, there is no significant difference in the activity for any of the compounds in any cell line.
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Bio Calculators
* Our calculator is based on the following equation:
Concentration (start) x Volume (start) = Concentration (final) x Volume (final)
It is commonly abbreviated as: C1V1 = C2V2
* Total Molecular Weight:
g/mol
Tip: Chemical formula is case sensitive. C22H30N4O √ c22h30n40 ╳
