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TCS 359 Structure

TCS 359

Chemical Properties

Boiling point 454.4±45.0 °C(Predicted)
Density  1.328±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Store in freezer, under -20°C
solubility  H2O: <2mg/mL
form  White solid
pka 12.43±0.20(Predicted)
color  white to off-white
Water Solubility  H2O: <2mg/mL
DMSO: ~8mg/mL
Sensitive  Light Sensitive
InChI 1S/C18H20N2O4S/c1-23-12-8-7-10(9-13(12)24-2)17(22)20-18-15(16(19)21)11-5-3-4-6-14(11)25-18/h7-9H,3-6H2,1-2H3,(H2,19,21)(H,20,22)
InChIKey FSPQCTGGIANIJZ-UHFFFAOYSA-N
SMILES COc1ccc(cc1OC)C(=O)Nc2sc3CCCCc3c2C(N)=O
CAS DataBase Reference 301305-73-7

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26
WGK Germany  3
HS Code  2934.99.4400
Storage Class 11 - Combustible Solids

Usage And Synthesis

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