Pyributicarb

Chemical Properties

Melting point	85～88℃
Boiling point	427.8±55.0 °C(Predicted)
Density	1.1453 (rough estimate)
refractive index	1.6000 (estimate)
storage temp.	0-6°C
solubility	DMSO : 100 mg/mL (302.63 mM);Water : < 0.1 mg/mL (insoluble)
form	Solid
pka	1.22±0.10(Predicted)
color	White to off-white
InChI	InChI=1S/C18H22N2O2S/c1-18(2,3)13-8-6-9-14(12-13)22-17(23)20(4)15-10-7-11-16(19-15)21-5/h6-12H,1-5H3
InChIKey	VTRWMTJQBQJKQH-UHFFFAOYSA-N
SMILES	C(=S)(OC1=CC=CC(C(C)(C)C)=C1)N(C1=NC(OC)=CC=C1)C