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2641451-78-5

Name INDEX NAME NOT YET ASSIGNED
CAS 2641451-78-5
Molecular Formula C20H24BrN3O3
Molecular Weight 434.33
MOL File 2641451-78-5.mol
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Chemical Properties

Boiling point  544.5±50.0 °C(Predicted)
density  1.370±0.06 g/cm3(Predicted)
pka 3.79±0.41(Predicted)
InChI InChI=1/C20H24BrN3O3/c1-15(26-2)19-18(21)12-17(13-22-19)23-8-10-24(11-9-23)20(25)27-14-16-6-4-3-5-7-16/h3-7,12-13,15H,8-11,14H2,1-2H3/t15-/s3
InChIKey GZAXUIABEACAHV-UJHUVDBMNA-N
SMILES BrC1C(=NC=C(N2CCN(C(=O)OCC3C=CC=CC=3)CC2)C=1)[C@H](C)OC |&1:23,r|

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