5-tert-Butyl-1,3-diiminoisoindoline
- Product Name5-tert-Butyl-1,3-diiminoisoindoline
- CAS52319-97-8
- CBNumberCB3389560
- MFC12H15N3
- MW201.27
- MDL NumberMFCD00216601
- MOL File52319-97-8.mol
Chemical Properties
| Melting point: | 229-232 °C (dec.)(lit.) |
| Boiling point: | 335.1±35.0 °C(Predicted) |
| Density | 1.18±0.1 g/cm3(Predicted) |
| pka | 8.70±0.20(Predicted) |
| InChI | InChI=1S/C12H15N3/c1-12(2,3)7-4-5-8-9(6-7)11(14)15-10(8)13/h4-6H,1-3H3,(H3,13,14,15) |
| InChIKey | QFTATDRGOXHSPJ-UHFFFAOYSA-N |
| SMILES | C1(=N)C2=C(C=C(C(C)(C)C)C=C2)C(N)=N1 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| HS Code | 2933990099 |