3 5-DINITROBENZOIC ACID 99% (C005B-092475)

General description

3,5-Dinitrobenzoic acid forms an adduct with 3,5-dimethylpyridine and the crystal structure of adduct has been studied at room temperature and 80K for both undeuterated and deuterated compounds. It forms 1:1 cocrystal with analgesic drug, ethenzamide and exists in two polymorphic forms.

Application

3,5-Dinitrobenzoic acid was used in the derivatization of resins and determination of ampicillin.

Molecular Weight: 212.12. Empirical Formula: C₇H₄N₂O₆. linearFormula: (O₂N)₂C₆H₃CO₂H. Quality Level: 200. Assay: 99%. form: solid. mp: 204-206 . °C (lit.). solubility: ethanol: soluble 0.5 . g/10 mL, clear, yellow to very deep greenish-yellow. SMILES string: OC(: O)c1cc(cc(c1)[N+]([O-]): O)[N+]([O-]): O. InChI: 1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11). InChI key: VYWYYJYRVSBHJQ-UHFFFAOYSA-N. Pictograms: GHS07. Signal Word: Warning. Hazard Statements: H302 - H315 - H319 - H335 - H413. Precautionary Statements: P261 - P264 - P273 - P301 + P312 - P302 + P352 - P305 + P351 + P338. Hazard Classifications: Acute Tox. 4 Oral - Aquatic Chronic 4 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3. Target Organs: Respiratory system. Storage Class Code: 11 - Combustible Solids. WGK: WGK 3. Flash Point(F): Not applicable. Flash Point(C): Not applicable. Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves.