Identification Chemical Properties Hazard Information Supplier

1270138-40-3

Name NSI-189
CAS 1270138-40-3
EINECS(EC#) 1592732-453-0
Molecular Formula C22H30N4O
MDL Number MFCD26959792
Molecular Weight 366.5
MOL File 1270138-40-3.mol

Chemical Properties

Boiling point  534.7±50.0 °C(Predicted)
density  1.134±0.06 g/cm3(Predicted)
storage temp.  -20°C
solubility  Soluble in DMSO
form  A crystalline solid
pka 6.18±0.10(Predicted)
color  White to yellow
λmax 254 nm
InChI InChI=1S/C22H30N4O/c1-18(2)10-12-24-21-20(9-6-11-23-21)22(27)26-15-13-25(14-16-26)17-19-7-4-3-5-8-19/h3-9,11,18H,10,12-17H2,1-2H3,(H,23,24)
InChIKey DYTOQURYRYYNOR-UHFFFAOYSA-N
SMILES C(C1=CC=CN=C1NCCC(C)C)(N1CCN(CC2=CC=CC=C2)CC1)=O

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