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| IUPAC Name: | 2-bromobenzonitrile |
| Description: | 2-Bromobenzonitrile (CAS# 2042-37-7) 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. |
| Molecular Weight: | 182.02 |
| Molecular Formula: | C7H4BrN |
| Canonical SMILES: | C1=CC=C(C(=C1)C#N)Br |
| InChI: | InChI=1S/C7H4BrN/c8-7-4-2-1-3-6(7)5-9/h1-4H |
| InChI Key: | AFMPMSCZPVNPEM-UHFFFAOYSA-N |
| Boiling Point: | 251-253 ℃ |
| Melting Point: | 52-56 ℃ |
| Purity: | 98 % |
| Density: | 1.496 g/cm3 |
| Appearance: | White to light yellow crystal powder |
| Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| MDL: | MFCD00001772 |
| LogP: | 2.32078 |
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