D131

3,5-Dinitrocatechol

solid

• Sinônimo(s): 3,5-Dinitro-1,2-benzenediol, OR-486
• Fórmula empírica (Notação de Hill): C₆H₄N₂O₆
• Número CAS: 7659-29-2
• Peso molecular: 200.11
• Número MDL: MFCD00069263
• Código UNSPSC: 12352202
• ID de substância PubChem: 24278158
• NACRES: NA.77

Propriedades

• fonte biológica: synthetic (organic)
• Ensaio: ≥98% (HPLC)
• Formulário: solid
• cor: yellow
• pf: 168-170 °C
• solubilidade: 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
• temperatura de armazenamento: 2-8°C
• cadeia de caracteres SMILES: 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
• chave InChI: VDCDWNDTNSWDFJ-UHFFFAOYSA-N
• Informações sobre genes: human ... COMT(1312)

Descrição

Aplicação

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.

Ações bioquímicas/fisiológicas

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.

Qualidade

Solutions may be stored for several days at 4 °C.

Atenção

Photosensitive

Informações de segurança

• Código de classe de armazenamento: 11 - Combustible Solids
• Classe de risco de água (WGK): WGK 3
• Ponto de fulgor (°F): Not applicable
• Ponto de fulgor (°C): Not applicable
• Equipamento de proteção individual: Eyeshields, Gloves, type N95 (US)