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| IUPAC Name: | 2-(3-nitrophenyl)acetonitrile |
| Description: | 3-Nitrophenylacetonitrile (CAS# 621-50-1) is a compound useful in organic synthesis. |
| Molecular Weight: | 162.15 |
| Molecular Formula: | C8H6N2O2 |
| Canonical SMILES: | C1=CC(=CC(=C1)[N+](=O)[O-])CC#N |
| InChI: | InChI=1S/C8H6N2O2/c9-5-4-7-2-1-3-8(6-7)10(11)12/h1-3,6H,4H2 |
| InChI Key: | WAVKEPUFQMUGBP-UHFFFAOYSA-N |
| Boiling Point: | 180 °C (3 torr) |
| Melting Point: | 60-62 °C |
| Purity: | 95 % |
| Density: | 1.272 g/cm3 |
| Appearance: | Pale yellow solid |
| MDL: | MFCD00041249 |
| LogP: | 2.18408 |
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