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ML213 Structure

ML213

Chemical Properties

Boiling point 398.8±11.0 °C(Predicted)
Density  1.106±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  DMSO: soluble5mg/mL, clear (warmed)
pka 14.79±0.70(Predicted)
form  powder
color  white to beige
InChI 1S/C17H23NO/c1-10-6-11(2)16(12(3)7-10)18-17(19)15-9-13-4-5-14(15)8-13/h6-7,13-15H,4-5,8-9H2,1-3H3,(H,18,19)
InChIKey SIQGKPGBLYKQBB-UHFFFAOYSA-N
SMILES N(c3c(cc(cc3C)C)C)C(=O)C1C2CC(C1)CC2

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Chronic 4
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Usage And Synthesis

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