2-Chloro-4-(1H-Pyrazol-5-Yl)Benzonitrile
化学名:2-Chloro-4-(1H-Pyrazol-5-Yl)Benzonitrile
CAS番号.1297537-37-1
英語名:2-Chloro-4-(1H-Pyrazol-5-Yl)Benzonitrile
CBNumberCB33144227
MFC10H6ClN3
MW203.63
MOL File1297537-37-1.mol
2-Chloro-4-(1H-Pyrazol-5-Yl)Benzonitrile物理性質
| 沸点 | 459.0±35.0 °C(Predicted) |
| 比重(密度) | 1.41±0.1 g/cm3(Predicted) |
| 酸解離定数(Pka) | 12.06±0.10(Predicted) |
| InChI | InChI=1S/C10H6ClN3/c11-9-5-7(1-2-8(9)6-12)10-3-4-13-14-10/h1-5H,(H,13,14) |
| InChIKey | BCINLNFBTLIGBU-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(C2C=CNN=2)C=C1Cl |
| LogP | 2.4 |
