4-[(4-CHLORO-2-PYRIMIDINYL)AMINO]BENZONITRILE
- Product Name4-[(4-CHLORO-2-PYRIMIDINYL)AMINO]BENZONITRILE
- CAS244768-32-9
- MFC11H7ClN4
- MW230.65
- EINECS607-384-4
- MOL File244768-32-9.mol
Chemical Properties
| Melting point | 210 °C(dec.) |
| Boiling point | 441.0±51.0 °C(Predicted) |
| Density | 1.39±0.1 g/cm3(Predicted) |
| vapor pressure | 0-0Pa at 20-25℃ |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | Methanol |
| form | Solid |
| pka | 2.15±0.10(Predicted) |
| color | Cream |
| InChI | InChI=1S/C11H7ClN4/c12-10-5-6-14-11(16-10)15-9-3-1-8(7-13)2-4-9/h1-6H,(H,14,15,16) |
| InChIKey | QXCHAADSAYQDHL-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(NC2=NC=CC(Cl)=N2)C=C1 |
| LogP | 2.8 at pH7 |