86445-22-9

Name Auxinole
CAS 86445-22-9
Molecular Formula C20H19NO3
MDL Number MFCD31657391
Molecular Weight 321.37
MOL File 86445-22-9.mol
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Chemical Properties

Melting point  <170°C (dec.)
Boiling point  586.9±50.0 °C(Predicted)
density  1.260±0.06 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly, Sonicated)
form  Solid
pka 4.77±0.37(Predicted)
color  Off-White to Light Brown
InChI InChI=1S/C20H19NO3/c1-12-7-8-14(13(2)9-12)19(22)10-16(20(23)24)17-11-21-18-6-4-3-5-15(17)18/h3-9,11,16,21H,10H2,1-2H3,(H,23,24)
InChIKey HGUYAIJBXSQXGV-UHFFFAOYSA-N
SMILES C(C1=CNC2C=CC=CC1=2)(C(=O)O)CC(C1C=CC(C)=CC=1C)=O

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