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| IUPAC Name: | 3-methoxybenzonitrile |
| Description: | 3-Methoxybenzonitrile (CAS# 1527-89-5) is a useful synthetic intermediate. It was used in the synthesis of new organic pigments which were evaluated as the active medium of the solid-state dye laser. It can also undergo dealkylation on treatment with SiCl4/LiI and BF3. |
| Molecular Weight: | 133.15 |
| Molecular Formula: | C8H7NO |
| Canonical SMILES: | COC1=CC=CC(=C1)C#N |
| InChI: | InChI=1S/C8H7NO/c1-10-8-4-2-3-7(5-8)6-9/h2-5H,1H3 |
| InChI Key: | KLXSUMLEPNAZFK-UHFFFAOYSA-N |
| Boiling Point: | 111-112 ℃ (13 mmHg) |
| Melting Point: | 20-22 ℃ |
| Purity: | 97+ % |
| Density: | 1.089 g/cm3 |
| Appearance: | Clear colourless to light yellow liquid |
| Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| MDL: | MFCD00001801 |
| LogP: | 1.56688 |
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