156167

3-Hydroxy-4-nitrobenzaldehyde

97%

• Fórmula lineal: HOC₆H₃(NO₂)CHO
• Número de CAS: 704-13-2
• Peso molecular: 167.12
• Beilstein/REAXYS Number: 2556882
• EC Number: 211-879-7
• MDL number: MFCD00007109
• UNSPSC Code: 12352100
• PubChem Substance ID: 24849596
• NACRES: NA.22

Propiedades

• assay: 97%
• form: solid
• mp: 127-131 °C (lit.)
• SMILES string: [H]C(=O)c1ccc(c(O)c1)[N+]([O-])=O
• InChI: 1S/C7H5NO4/c9-4-5-1-2-6(8(11)12)7(10)3-5/h1-4,10H
• InChI key: AUBBVPIQUDFRQI-UHFFFAOYSA-N

Descripción

Application

3-Hydroxy-4-nitrobenzaldehyde is the aldehyde component in a study of an enantioselective thioester aldol reaction. This reaction has been catalyzed by copper(II) triflate in the presence of a chiral bisoxazoline ligand. The product has been used as a chromophoric substrate for probing the catalytic mechanism of horse liver alcohol dehydrogenase.

Información de seguridad

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: dust mask type N95 (US), Eyeshields, Gloves