1285572-55-5

Name Dotinurad Impurity 2
CAS 1285572-55-5
Molecular Formula C14H9Cl2NO3S
Molecular Weight 342.2
MOL File 1285572-55-5.mol
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Chemical Properties

Boiling point  592.3±50.0 °C(Predicted)
density  1.73±0.1 g/cm3(Predicted)
pka 4.82±0.25(Predicted)
InChI InChI=1S/C14H9Cl2NO3S/c15-9-5-8(6-10(16)13(9)18)14(19)17-7-21(20)12-4-2-1-3-11(12)17/h1-6,18H,7H2
InChIKey LQNDVNGYLFJLGJ-UHFFFAOYSA-N
SMILES C(C1=CC(Cl)=C(O)C(Cl)=C1)(N1C2=CC=CC=C2S(=O)C1)=O

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