N-(4-Chloro-2,5-dimethoxyphenyl)-5-cyclopropyl-3-isoxazolecarboxamide
C15H15ClN2O4
912798-42-6 Copyright (C) 2025 ACS
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    6.9300    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6200    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8500    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3100    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <cas.rn>
912798-42-6

> <cas.index.name>
3-Isoxazolecarboxamide, N-(4-chloro-2,5-dimethoxyphenyl)-5-cyclopropyl-

> <molecular.formula>
C15H15ClN2O4

> <molecular.weight>
322.74

> <boiling.point.predicted>
422.894±45.00 °C    Press: 760.00 Torr

> <density.predicted>
1.390±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
9.261±0.70    Most Acidic Temp: 25 °C

$$$$
