586-78-7
| Name | 1-Bromo-4-nitrobenzene |
| CAS | 586-78-7 |
| EINECS(EC#) | 209-583-8 |
| Molecular Formula | C6H4BrNO2 |
| MDL Number | MFCD00007280 |
| Molecular Weight | 202.01 |
| MOL File | 586-78-7.mol |
Chemical Properties
| Appearance | light yellow powder |
| Melting point | 124-126 °C(lit.) |
| Boiling point | 255-256 °C(lit.) |
| density | 1,95 g/cm3 |
| refractive index | 1.6060 (estimate) |
| Fp | 254-256°C |
| storage temp. | Store below +30°C. |
| solubility | soluble in Chloroform |
| form | Crystalline Powder |
| color | Light yellow |
| Water Solubility | insoluble |
| BRN | 636964 |
| Henry's Law Constant | 2.2×10-1 mol/(m3Pa) at 25℃, Li et al. (2014) |
| InChI | 1S/C6H4BrNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H |
| InChIKey | ZDFBKZUDCQQKAC-UHFFFAOYSA-N |
| SMILES | [O-][N+](=O)c1ccc(Br)cc1 |
| CAS DataBase Reference | 586-78-7(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzene, 1-bromo-4-nitro-(586-78-7) |
| EPA Substance Registry System | 586-78-7(EPA Substance) |
Safety Data
| Symbol(GHS) |    GHS07,GHS06,GHS08 |
| Signal word | Warning |
| Hazard statements | H312-H331-H335-H373-H302-H301+H311+H331-H315-H319 |
| Precautionary statements | P260-P304+P340-P305+P351+P338-P501a-P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501 |
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 3459 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | CY9040550 |
| TSCA | Yes |
| REACH Registrations | Active |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29049085 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Oral |