1-[4-[2-(4-Methylphenyl)-1,2-diphenylethenyl]phenyl]-1H-pyrrole-2,5-dione
C31H23NO2
1245606-71-6 Copyright (C) 2025 ACS
 34 38  0  0  0  0  0  0  0  0999 V2000
    8.5298    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2998    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.2198    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2198    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    4.5647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2 24  1  0  0  0  0
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M  END
> <cas.rn>
1245606-71-6

> <ca.index.name>
1H-Pyrrole-2,5-dione, 1-[4-[2-(4-methylphenyl)-1,2-diphenylethenyl]phenyl]-

> <molecular.formula>
C31H23NO2

> <smiles.canonical>
O=C1C=CC(=O)N1C2=CC=C(C=C2)C(C=3C=CC=CC3)=C(C=4C=CC=CC4)C5=CC=C(C=C5)C

> <molecular.weight>
441.52

> <boiling.point.predicted>
565.653±29.00 °C    Press: 760.00 Torr

> <density.predicted>
1.218±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
-2.018±0.20    Most Basic Temp: 25 °C

$$$$
