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3,5-Dinitrocatechol
产品别名
7659-29-2
3,5-Dinitrocatechol
OR-486
3,5-Dinitro-1,2-benzenediol
结构式
基本信息
| Empirical Formula【经验(实验)分子式】 | C6H4N2O6 |
| Molecular weight | 200.11 |
| MDL number | MFCD00069263 |
| PubChem Substance ID【PubChem化学物质编号】 | 24278158 |
| NACRES | NA.77 |
| Application【应用】 | 3,5-Dinitrocatechol (3,5-DNC) has been used in the preparation of the molybdenum (VI)-(3,5-DNC) complex. It has also been used as a catechol-O-methyltransferase (COMT) inhibitor and as a positive control for screening human COMT inhibition. Chelating reagent used in a sensitive (μM) assay for vanadium. |
| Biochem/physiol Actions【生化/生理作用】 | Selective inhibitor of catechol O-methyl transferase (COMT); penetrates the blood brain barrier and is useful both orally and parenteraly in experiments where inhibition of COMT in the central nervous system is required. |
| Quality【质量】 | Solutions may be stored for several days at 4 ℃. |
| Caution【注意】 | Photosensitive |
产品性质
| Quality Level【质量水平】 | 200 |
| biological source【生物来源】 | synthetic (organic) |
| Assay【测定】 | ≥98% (HPLC) |
| form【形式】 | solid |
| color【颜色】 | yellow |
| mp | 168-170 ℃ |
| solubility【溶解性】 | H2O: slightly soluble 0.17 mg/mL 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 2.8 mg/mL 0.1 M HCl: slightly soluble DMSO: soluble aqueous buffer pH > 5: soluble ethanol: soluble |
| storage temp.【储存温度】 | 2-8℃ |
| SMILES string | Oc1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O |
| InChI | 1S/C6H4N2O6/c9-5-2-3(7(11)12)1-4(6(5)10)8(13)14/h1-2,9-10H |
| InChI key | VDCDWNDTNSWDFJ-UHFFFAOYSA-N |
| Gene Information | human ... COMT(1312) |
| packaging【包装】 | 250 mg in poly bottle 50 mg in glass insert |
安全信息
| Storage Class Code【储存分类代码】 | 13 - Non Combustible Solids |
| WGK | WGK 3 |
| Personal Protective Equipment【个人防护装备】 | Eyeshields, Gloves, type N95 (US) |
