3,5-Dinitrobenzoic acid
ALDRICH/121258 - 99%
Synonym: DNBA
CAS Number: 99-34-3
Empirical Formula (Hill Notation): C7H4N2O6
Molecular Weight: 212.12
EC Number: 202-751-1
MDL Number: MFCD00007253
Linear Formula: (O2N)2C6H3CO2H
Product Type: Chemical
| assay | 99% |
| form | solid |
| functional group | carboxylic acid |
| nitro | |
| InChI | 1S/C7H4N2O6/c10-7(11)4-1- |
| InChI key | VYWYYJYRVSBHJQ-UHFFFAOYSA |
| mp | 204-206 °C (lit.) |
| Quality Level | 200 ![]() |
| SMILES string | OC(=O)c1cc(cc(c1)[N+]([O- |
| solubility | ethanol: soluble 0.5 g/10 mL, clear, yellow to very deep greenish-yellow |
| Application: | 3,5-Dinitrobenzoic acid was used in the derivatization of resins and determination of ampicillin. |
| 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. |
| Packaging: | 100, 500 g in poly bottle |
| Symbol | GHS07 |
| Signal word | Warning |
| Hazard statements | H302 - H315 - H319 - H335 - H413 |
| Precautionary statements | P261 - P264 - P273 - P301 + P312 - P302 + P352 - P305 + P351 + P338 |
| Hazard Codes | Xn |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | 99% |
| mp | 204-206 °C (lit.) |
| UNSPSC | 12352100 |


