2-Bromobenzonitrile
- CAS NO.：2042-37-7
- Empirical Formula: C7H4BrN
- Molecular Weight: 182.02
- MDL number: MFCD00001772
- EINECS: 218-045-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-06-28 13:54:27
What is 2-Bromobenzonitrile?
Chemical properties
white to light yellow crystal powder
The Uses of 2-Bromobenzonitrile
2-Bromobenzonitrile belongs to a group of ortho-substituted bromobenzenes that have varying hepatotoxicity effects in the presence of rat liver microsomes in vitro. 2-Bromobenzonitrile is also used as a starting material to synthesize novel benzothiophene derivatives that were found to exhibit antibacterial and antifungal activity. It is commonly employed in reactions that require an electron-rich species to carry out nucleophilic substitution (or addition) reactions.
Properties of 2-Bromobenzonitrile
| Melting point: | 53-57 °C(lit.) |
| Boiling point: | 251-253 °C(lit.) |
| Density | 1.496 |
| refractive index | 1.5999 (estimate) |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | 10.5g/l |
| form | Crystalline Solid |
| color | White to yellow |
| PH | 6.6 (10.5g/l, H2O, 23℃) |
| BRN | 2042185 |
| CAS DataBase Reference | 2042-37-7(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzonitrile, 2-bromo-(2042-37-7) |
Safety information for 2-Bromobenzonitrile
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06 |
| GHS Hazard Statements |
H301:Acute toxicity,oral H312:Acute toxicity,dermal H319:Serious eye damage/eye irritation H412:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 2-Bromobenzonitrile
| InChIKey | AFMPMSCZPVNPEM-UHFFFAOYSA-N |
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