1660114-31-7

Name NIK SMI1
CAS 1660114-31-7
Molecular Formula C20H19N3O4
MDL Number MFCD31715434
Molecular Weight 365.38
MOL File 1660114-31-7.mol
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Chemical Properties

Boiling point  626.7±55.0 °C(Predicted)
density  1.39±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : 100 mg/mL (273.69 mM)
form  Solid
pka 11.14±0.20(Predicted)
color  Off-white to pink
InChI 1S/C20H19N3O4/c1-23-9-8-20(26,19(23)25)7-6-13-4-3-5-14(10-13)16-11-15(27-2)12-17(22-16)18(21)24/h3-5,10-12,26H,8-9H2,1-2H3,(H2,21,24)/t20-/m0/s1
InChIKey LQSHXYHWYGKAMX-FQEVSTJZSA-N
SMILES NC(C1=NC(C2=CC(C#C[C@]3(C(N(CC3)C)=O)O)=CC=C2)=CC(OC)=C1)=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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