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| IUPAC Name: | 3-hydroxy-1,2-dimethylpyridin-4-one |
| Description: | A chelator that could replace disferrioxamine. It is orally and parenterally effective in the removal of iron in vivo from rabbits and mice and also from transferrin and ferritin in vitro. |
| Molecular Weight: | 139.15 |
| Molecular Formula: | C7H9NO2 |
| Canonical SMILES: | CC1=C(C(=O)C=CN1C)O |
| InChI: | InChI=1S/C7H9NO2/c1-5-7(10)6(9)3-4-8(5)2/h3-4,10H,1-2H3 |
| InChI Key: | TZXKOCQBRNJULO-UHFFFAOYSA-N |
| Boiling Point: | 232.7 °C at 760 mmHg |
| Melting Point: | 272-275 °C(lit.) |
| Flash Point: | 94.5±27.3 °C |
| Purity: | 99 % |
| Density: | 1.225 g/cm3 |
| Solubility: | In Vitro: DMSO : 7.14 mg/mL(51.31 mM;Need ultrasonic) H2O : 3.33 mg/mL(23.93 mM;Need ultrasonic) In Vivo: 1.Add each solvent one by one:PBS Solubility: 10 mg/mL (71.86 mM); Clear solution; Need ultrasonic 2.Add each solvent one by one:10% DMSO >> 40%PEG300 >> 5%Tween-80 >> 45% saline Solubility: ≥ 0.71 mg/mL (5.10 mM); Clear solution 3.Add each solvent one by one:10% DMSO >> 90% (20%SBE-β-CDin saline) Solubility: ≥ 0.71 mg/mL (5.10 mM); Clear solution 4.Add each solvent one by one:10% DMSO >> 90%corn oil Solubility: ≥ 0.71 mg/mL (5.10 mM); Clear solution |
| Appearance: | White to off-white (Solid) |
| Storage: | Powder: -20°C: 3 years; 4°C: 2 years; In solvent: -80°C: 6 months; -20°C: 1 month |
| LogP: | 0.39930 |
| Stability: | Stable under recommended storage conditions |
| Vapor Pressure: | 0.0±1.0 mmHg at 25°C |
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Carbonyl Compounds
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
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