Melting point: |
208.0 to 212.0 °C |
Boiling point: |
362.0±37.0 °C(Predicted) |
Density |
1.474±0.06 g/cm3(Predicted) |
storage temp. |
under inert gas (nitrogen or Argon) at 2–8 °C |
solubility |
DMSO (Slightly), Methanol (Sparingly) |
form |
powder to crystal |
pka |
11.09±0.70(Predicted) |
color |
White to Light yellow |
InChI |
InChI=1S/C11H10ClN3OS/c1-6-3-2-4-7(12)9(6)15-10(16)8-5-14-11(13)17-8/h2-5H,1H3,(H2,13,14)(H,15,16) |
InChIKey |
VVOXTERFTAJMAA-UHFFFAOYSA-N |
SMILES |
S1C(C(NC2=C(C)C=CC=C2Cl)=O)=CN=C1N |
CAS DataBase Reference |
302964-24-5(CAS DataBase Reference) |