4-[[[3,5-Bis(1,1-dimethylethyl)phenyl]methyl][2-[[(4-chlorophenyl)methyl][(2,...
C37H36ClF5N2O5S
1834571-82-2 Copyright (C) 2025 ACS
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M  END
> <cas.rn>
1834571-82-2

> <ca.index.name>
Benzoic acid, 4-[[[3,5-bis(1,1-dimethylethyl)phenyl]methyl][2-[[(4-chlorophenyl)methyl][(2,3,4,5,6-pentafluorophenyl)sulfonyl]amino]acetyl]amino]-

> <molecular.formula>
C37H36ClF5N2O5S

> <smiles.canonical>
O=C(O)C1=CC=C(C=C1)N(C(=O)CN(CC2=CC=C(Cl)C=C2)S(=O)(=O)C=3C(F)=C(F)C(F)=C(F)C3F)CC=4C=C(C=C(C4)C(C)(C)C)C(C)(C)C

> <molecular.weight>
751.20

> <boiling.point.predicted>
756.296±70.00 °C    Press: 760.00 Torr

> <density.predicted>
1.363±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
4.280±0.10    Most Acidic Temp: 25 °C

$$$$
