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MC1568 Structure

MC1568

Chemical Properties

Melting point 212-215 °C(Solv: acetonitrile (75-05-8); methanol (67-56-1))
Density  1.21±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: ≥10mg/mL
form  powder
pka 8.91±0.23(Predicted)
color  orange
InChI 1S/C17H15FN2O3/c1-20-14(5-6-15(20)8-10-17(22)19-23)7-9-16(21)12-3-2-4-13(18)11-12/h2-11,23H,1H3,(H,19,22)/b9-7+,10-8+
InChIKey QRDAPCMJAOQZSU-KQQUZDAGSA-N
SMILES Cn1c(\C=C\C(=O)NO)ccc1\C=C\C(=O)c2cccc(F)c2
CAS DataBase Reference 852475-26-4

Safety Information

Hazard Codes  Xn,Xi
Risk Statements  22-36
Safety Statements  26
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2

Usage And Synthesis

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