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CAY10415 Structure

CAY10415

Chemical Properties

Boiling point 623.8±55.0 °C(Predicted)
Density  1.315±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  ≥37 mg/mL in DMSO; insoluble in EtOH; insoluble in H2O
form  A crystalline solid
pka 6.32±0.50(Predicted)
color  white to beige
InChI 1S/C19H18N2O4S/c1-2-12-5-8-15(20-10-12)16(22)11-25-14-6-3-13(4-7-14)9-17-18(23)21-19(24)26-17/h3-8,10,17H,2,9,11H2,1H3,(H,21,23,24)
InChIKey IRNJSRAGRIZIHD-UHFFFAOYSA-N
SMILES CCC1=CN=C(C(COC2=CC=C(CC3SC(NC3=O)=O)C=C2)=O)C=C1

Safety Information

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Usage And Synthesis

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