5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid 97%
Product information "5-(4-Cyanophenyl)isoxazole-3-carboxylic Acid 97%"
General Information
| Catalog #: | AS25621-G1 |
|---|---|
| Formula: | C11H6N2O3 |
| Mass: | 214.18 |
| C.A.S. / related C.A.S: | 1375064-45-1 |
| MDL: | MFCD22192327 |
| Appearance: | solid |
| Colour: | clear |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 29420000 |
| Stock: | > 5 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 1.91148 |
|---|---|
| LabuteASA: | 90.53205064 |
| TPSA: | 87.12 |
| NumRotatableBonds: | 2 |
| NumHBD: | 1 |
| NumHBA: | 4 |
| NumHeavyAtoms: | 16 |
| NumRings: | 2 |