1-(3-Fluorophenyl)-2-thiourea
- Product Name1-(3-Fluorophenyl)-2-thiourea
- CAS458-05-9
- CBNumberCB8230821
- MFC7H7FN2S
- MW170.21
- MDL NumberMFCD00041167
- MOL File458-05-9.mol
- MSDS FileSDS
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) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
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| Signal word | Danger | |||||||||
| Hazard statements | H301-H315-H319-H335 | |||||||||
| Precautionary statements | P301+P310+P330-P302+P352-P305+P351+P338 | |||||||||
| 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 | |||||||||
| NFPA 704: |
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