3-(4-Bromophenyl)propionic acid
- Product Name3-(4-Bromophenyl)propionic acid
- CAS1643-30-7
- MFC9H9BrO2
- MW229.07
- EINECS629-097-3
- MOL File1643-30-7.mol
Chemical Properties
| Melting point | 133-136 °C (lit.) |
| Boiling point | 250°C/30mmHg(lit.) |
| Density | 1.531±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | soluble in Methanol |
| pka | 4.60±0.10(Predicted) |
| form | Crystalline Powder |
| color | White to light yellow or beige |
| InChI | InChI=1S/C9H9BrO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12) |
| InChIKey | NCSTWHYWOVZDOC-UHFFFAOYSA-N |
| SMILES | C1(CCC(O)=O)=CC=C(Br)C=C1 |
| CAS DataBase Reference | 1643-30-7(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn,Xi |
| Risk Statements | 22-36/37/38 |
| Safety Statements | 26-36 |
| RIDADR | 3261 |
| WGK Germany | 3 |
| Hazard Note | Harmful/Irritant |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
