| Melting point |
approximate 213℃ (dec.) |
| Boiling point |
561.3±50.0 °C(Predicted) |
| Density |
1.61±0.1 g/cm3 (20 ºC 760 Torr) |
| storage temp. |
-20°C Freezer |
| solubility |
Chloroform (Slightly), DMSO (Slightly, Heated), Methanol (Slightly, Heated) |
| form |
Solid |
| pka |
10.03±0.70(Predicted) |
| color |
Pale Beige to Beige |
| Henry's Law Constant |
5.9×1012 mol/(m3Pa) at 25℃, Maniere et al. (2011) |
| Major Application |
agriculture
environmental |
| InChI |
InChI=1S/C19H14BrClN6O2/c1-10-6-11(9-22)7-12(18(28)23-2)16(10)25-19(29)14-8-15(20)26-27(14)17-13(21)4-3-5-24-17/h3-8H,1-2H3,(H,23,28)(H,25,29) |
| InChIKey |
DVBUIBGJRQBEDP-UHFFFAOYSA-N |
| SMILES |
N1(C2=NC=CC=C2Cl)C(C(NC2=C(C(NC)=O)C=C(C#N)C=C2C)=O)=CC(Br)=N1 |
| LogP |
4.630 (est) |
| EPA Substance Registry System |
1H-Pyrazole-5-carboxamide, 3-bromo-1-(3-chloro-2-pyridinyl)-N-[4-cyano-2-methyl-6-[(methylamino)carbonyl]phenyl]- (736994-63-1) |
