Ethyl 4-bromobenzoate
ALDRICH/363774 - 98%
CAS Number: 5798-75-4
Empirical Formula (Hill Notation): C9H9BrO2
Molecular Weight: 229.07
EC Number: 227-347-2
MDL Number: MFCD00016329
Linear Formula: BrC6H4CO2C2H5
Product Type: Chemical
| assay | 98% |
| bp | 131 °C/14 mmHg (lit.) |
| density | 1.403 g/mL at 25 °C (lit.) |
| form | liquid |
| InChI | 1S/C9H9BrO2/c1-2-12-9(11) |
| InChI key | XZIAFENWXIQIKR-UHFFFAOYSA |
| refractive index | n |
| SMILES string | CCOC(=O)c1ccc(Br)cc1 |
| General description: | Ethyl 4-bromobenzoate is an ester having electron-withdrawing substituent. It undergoes reduction with potassium diisobutyl-t-butoxyaluminum hydride (PDBBA) at 0°C to yield aldehydes. Reaction of ethyl 4-bromobenzoate and substituted benzyl chloride with zinc dust and a Pd catalyst is reported. |
| Packaging: | 25, 100 g in glass bottle |
| Hazard Codes | N |
| Risk Statements | 51/53 |
| Safety Statements | 61 |
| RIDADR | UN 3082 9 / PGIII |
| WGK Germany | WGK 3 |
| Flash Point(F) | > 235.4 °F - closed cup |
| Flash Point(C) | > 113 °C - closed cup |
| Purity | 98% |
| bp | 131 °C/14 mmHg (lit.) |
| Density | 1.403 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |