1-(3-FLUOROPHENYL)-2-THIOUREA
- Product Name1-(3-FLUOROPHENYL)-2-THIOUREA
- CAS458-05-9
- MFC7H7FN2S
- MW170.21
- EINECS
- MOL File458-05-9.mol
Chemical Properties
| Melting point | 114-117 °C (lit.) |
| Boiling point | 259.3±42.0 °C(Predicted) |
| Density | 1.397±0.06 g/cm3(Predicted) |
| pka | 12.61±0.70(Predicted) |
| form | solid |
| BRN | 2718454 |
| InChI | 1S/C7H7FN2S/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11) |
| InChIKey | YKOBLHQALWQKTC-UHFFFAOYSA-N |
| SMILES | NC(=S)Nc1cccc(F)c1 |
| CAS DataBase Reference | 458-05-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | T,Xi |
| Risk Statements | 25-36/37/38 |
| Safety Statements | 26-36-45 |
| RIDADR | UN 2811 6.1/PG 3 |
| WGK Germany | 3 |
| Hazard Note | Toxic |
| HazardClass | 6.1 |
| PackingGroup | II |
| HS Code | 29309090 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
