4-Bromothioanisole
ALDRICH/196525 - 97%
Synonym: 4-Bromophenyl methyl sulfide
CAS Number: 104-95-0
Empirical Formula (Hill Notation): C7H7BrS
Molecular Weight: 203.10
EC Number: 203-255-8
MDL Number: MFCD00000102
Linear Formula: BrC6H4SCH3
Product Type: Chemical
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 196525-100G
| assay | 97% |
| bp | 128-130 °C/10 mmHg (lit.) |
| InChI | 1S/C7H7BrS/c1-9-7-4-2-6(8 |
| InChI key | YEUYZNNBXLMFCW-UHFFFAOYSA |
| mp | 38-40 °C (lit.) |
| Quality Level | 100  |
| SMILES string | CSc1ccc(Br)cc1 |
| Application: | 4-Bromothioanisole was used in the synthesis of: • 4′-nitro-4-mercaptobiph • 4′-iodo-4-mercaptobiphe • 3′-nitro-4-mercaptobiph • 3′-iodo-4-mercaptiobiph • (S)-(–)-p-bromophenyl methyl sulfoxide |
| General description: | 4-Bromothioanisole undergoes Heck olefination reaction with styrenes to yield stilbenes. |
| Packaging: | 25, 100 g in glass bottle |
| Symbol |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302 |
| Hazard Codes | Xn |
| Risk Statements | 22 |
| RIDADR | UN 3335 |
| WGK Germany | WGK 3 |
| Flash Point(F) | 235.4 °F - closed cup |
| Flash Point(C) | 113 °C - closed cup |
| Purity | 97% |
| bp | 128-130 °C/10 mmHg (lit.) |
| mp | 38-40 °C (lit.) |
| UNSPSC | 12352100 |