3,5-Dinitro-4-methylbenzoic acid
- Product Name3,5-Dinitro-4-methylbenzoic acid
- CAS16533-71-4
- CBNumberCB8675132
- MFC8H6N2O6
- MW226.14
- EINECS240-603-8
- MDL NumberMFCD00007175
- MOL File16533-71-4.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 155-158 °C(lit.) |
| Boiling point | 396.3±42.0 °C(Predicted) |
| Density | 1.593±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | methanol: soluble250mg/10 mL, clear, faintly yellow to yellow |
| form | Crystalline Powder |
| pka | 2.95±0.10(Predicted) |
| color | Yellow |
| BRN | 2507949 |
| InChI | InChI=1S/C8H6N2O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3,(H,11,12) |
| InChIKey | LZWWZQXBKVZKIP-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1=CC([N+]([O-])=O)=C(C)C([N+]([O-])=O)=C1 |
| CAS DataBase Reference | 16533-71-4(CAS DataBase Reference) |
| FDA UNII | HPM5AZ39WE |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36 | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 29163990 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 | |||||||||
| NFPA 704: |
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