5388-28-3
| Name | S-BENZYLISOTHIOUREA HYDROCHLORIDE |
| CAS | 5388-28-3 |
| EINECS(EC#) | 208-688-6 |
| Molecular Formula | C8H11ClN2S |
| MDL Number | MFCD00012583 |
| Molecular Weight | 202.7 |
| MOL File | 5388-28-3.mol |
Chemical Properties
| Melting point | 172-177 °C |
| Boiling point | 316.362±34.00 °C(Press: 760.00 Torr)(predicted) |
| density | 1.222±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| form | solid |
| pka | 0.745±0.10(predicted) |
| InChI | 1S/C6H6N4/c1-8-6-9-3-5(2-7)4-10-6/h3-4H,1H3,(H,8,9,10) |
| InChIKey | MCZXXEZSKWAWME-UHFFFAOYSA-N |
| SMILES | CNc1ncc(cn1)C#N |
| CAS DataBase Reference | 5388-28-3(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302-H317 |
| Precautionary statements | P280 |
| Hazard Codes | T |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2811 6.1/PG 2 |
| WGK Germany | 3 |
| RTECS | UM0738000 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Skin Sens. 1 |