5-(4-Methylphenyl)-1H-tetrazole
- Product Name5-(4-Methylphenyl)-1H-tetrazole
- CAS24994-04-5
- MFC8H8N4
- MW160.18
- EINECS
- MOL File24994-04-5.mol
Chemical Properties
| Melting point | 250-253 °C(lit.) |
| Boiling point | 260°C |
| Density | 1.241±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| solubility | soluble in Dimethylformamide |
| form | powder to crystal |
| pka | 4.44±0.10(Predicted) |
| color | White to Almost white |
| BRN | 131226 |
| InChI | InChI=1S/C8H8N4/c1-6-2-4-7(5-3-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12) |
| InChIKey | BCCJIAZPYBJASR-UHFFFAOYSA-N |
| SMILES | N1=C(C2=CC=C(C)C=C2)N=NN1 |
| CAS DataBase Reference | 24994-04-5(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| HS Code | 2933998090 |
