3-Bromophenyl isothiocyanate
- Product Name3-Bromophenyl isothiocyanate
- CAS2131-59-1
- MFC7H4BrNS
- MW214.08
- EINECS626-323-2
- MOL File2131-59-1.mol
Chemical Properties
| Melting point | 26 °C |
| Boiling point | 256 °C |
| Density | 1.50 |
| refractive index | 1.685 |
| Flash point | >110°C |
| form | powder to crystal |
| color | White to Almost white |
| Water Solubility | 24.41mg/L(25 ºC) |
| Sensitive | Moisture Sensitive |
| BRN | 2081173 |
| InChI | 1S/C7H4BrNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H |
| InChIKey | ZMGMGHNOACSMQN-UHFFFAOYSA-N |
| SMILES | Brc1cccc(c1)N=C=S |
| CAS DataBase Reference | 2131-59-1(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn,C |
| Risk Statements | 36/37/38-20/21/22-42 |
| Safety Statements | 36/37/39-26-45-36/37-22 |
| RIDADR | 2810 |
| WGK Germany | 3 |
| RTECS | NX8350000 |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29309099 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 STOT SE 3 |
| Toxicity | mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01285, |
