3-Bromocinnamic acid
- Product Name3-Bromocinnamic acid
- CAS32862-97-8
- MFC9H7BrO2
- MW227.05
- EINECS251-267-7
- MOL File32862-97-8.mol
Chemical Properties
| Melting point | 177-179 °C(lit.) |
| Boiling point | 344.1±25.0 °C(Predicted) |
| Density | 1.5403 (rough estimate) |
| refractive index | 1.5627 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | methanol: soluble |
| form | Crystalline Powder |
| pka | 4.27±0.10(Predicted) |
| color | White to light yellow |
| InChI | InChI=1S/C9H7BrO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12) |
| InChIKey | YEMUSDCFQUBPAL-SNAWJCMRSA-N |
| SMILES | C(O)(=O)C=CC1=CC=CC(Br)=C1 |
| CAS DataBase Reference | 32862-97-8(CAS DataBase Reference) |
| NIST Chemistry Reference | 3-Bromocinnamic acid(32862-97-8) |
| EPA Substance Registry System | m-Bromocinnamic acid (32862-97-8) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38-37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | GD8420000 |
| TSCA | TSCA listed |
| HazardClass | IRRITANT |
| HS Code | 29163990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
