
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 15119-34-3 |
| Catalog No. | 2A-9004420 |
| Chinese Name | 香豆素-3腈 |
| Synonyms | Coumarin-3-carbonitrile; MFCD00115699; 3-CYANOCOUMARIN; 2-oxochromene-3-carbonitrile |
| Molecular Formula | C10H5NO2 |
| Molecular Weight | 171.15 |
| Purity | 97 |
| Density | 1.34 g/cm3 |
| Boiling Point | 350.7ºC at 760 mmHg |
| Melting Point | 184-188 °C (lit.) |
| Appearance | solid |
| Storage Condition | Closed at room temperature, protected from light, |
| PubChem ID | 24881006 |
| MDL Number | MFCD00115699 |
| SMILES | O=C1Oc2ccccc2C=C1C#N |
| InChI | 1S/C10H5NO2/c11-6-8-5-7-3-1-2-4-9(7)13-10(8)12/h1-5H |
| InChI Key | QKJALQPLNMEDAV-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Transport Info | Product name: Coumarin-3-carbonitrile |
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