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| | 1-Bromo-4-nitrobenzene Basic information |
| | 1-Bromo-4-nitrobenzene Chemical Properties |
| 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 | Benzene, 1-bromo-4-nitro- (586-78-7) |
| Hazard Codes | Xn,Xi | | Risk Statements | 22-36/37/38-20/21/22-62-51/53-46-45 | | Safety Statements | 36/37/39-26-22-61-53-45 | | RIDADR | UN 2732 6.1/PG III (NITROBROMOBENZENES,
LIQUID) | | RIDADR | UN 3459 6.1/PG III (NITROBROMOBENZENES,
SOLID) | | WGK Germany | 3 | | RTECS | CY9040550 | | TSCA | TSCA listed | | 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 |
| | 1-Bromo-4-nitrobenzene Usage And Synthesis |
| Chemical Properties | light yellow powder | | Uses | It can be employed as a syntheses material intermediate. It is also used as a pharmaceutical intermediate. | | Synthesis Reference(s) | Tetrahedron, 43, p. 4321, 1987 DOI: 10.1016/S0040-4020(01)90307-2 | | Purification Methods | Crystallise it twice from pet ether, using charcoal before the first crystallisation. [Beilstein 5 III 619, 5 IV 729.] |
| | 1-Bromo-4-nitrobenzene Preparation Products And Raw materials |
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