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| IUPAC Name: | 3-(bromomethyl)benzonitrile |
| Description: | 3-(Bromomethyl)benzonitrile (CAS# 28188-41-2) is an intermediate used in the synthesis of 3-(bromomethyl)benzaldehyde. It also undergoes Suzuki cross-coupling reaction with bis(pinacolato)diboron. |
| Molecular Weight: | 196.04 |
| Molecular Formula: | C8H6BrN |
| Canonical SMILES: | C1=CC(=CC(=C1)CBr)C#N |
| InChI: | InChI=1S/C8H6BrN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5H2 |
| InChI Key: | CVKOOKPNCVYHNY-UHFFFAOYSA-N |
| Boiling Point: | 130 ℃ / 4 mmHg |
| Melting Point: | 92-97 ℃ |
| Purity: | 95 % |
| Density: | 1.51 g/cm3 |
| Appearance: | Almost white to beige crystalline powder |
| Storage: | Keep container closed when not in use. Corrosives area. Store protected from moisture. |
| MDL: | MFCD00001809 |
| LogP: | 2.45318 |
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