7697-26-9
| Name | 3-Bromo-4-methylbenzoic acid |
| CAS | 7697-26-9 |
| EINECS(EC#) | 231-712-1 |
| Molecular Formula | C8H7BrO2 |
| MDL Number | MFCD00002488 |
| Molecular Weight | 215.04 |
| MOL File | 7697-26-9.mol |
Chemical Properties
| Appearance | White to light yellow crystal powder |
| Melting point | 200-202 °C (lit.) 200-204 °C |
| Boiling point | 329.8±30.0 °C(Predicted) |
| density | 1.599±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| form | powder to crystal |
| pka | 3.98±0.10(Predicted) |
| color | White to Light yellow to Light orange |
| Water Solubility | Soluble in methanol. Insoluble in water. |
| BRN | 1936510 |
| InChI | 1S/C8H7BrO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3,(H,10,11) |
| InChIKey | ZFJOMUKPDWNRFI-UHFFFAOYSA-N |
| SMILES | Cc1ccc(cc1Br)C(O)=O |
| CAS DataBase Reference | 7697-26-9(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS06 |
| Signal word | Danger |
| Hazard statements | H301-H315-H319-H335 |
| Precautionary statements | P301+P310+P330-P302+P352-P305+P351+P338 |
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2811 6.1/PG 3 |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| PackingGroup | Ⅲ |
| HS Code | 29163990 |
| 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 |