3′-[3-[1-[[4-(1,1-Dimethylethyl)phenyl]methyl]-4-ethyl-4,5-dihydro-5-oxo-1H-1...
C34H41N3O4
1616372-41-8 Copyright (C) 2025 ACS
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M  END
> <cas.rn>
1616372-41-8

> <ca.index.name>
[1,1′-Biphenyl]-3-acetic acid, 3′-[3-[1-[[4-(1,1-dimethylethyl)phenyl]methyl]-4-ethyl-4,5-dihydro-5-oxo-1H-1,2,4-triazol-3-yl]propyl]-4-ethoxy-

> <molecular.formula>
C34H41N3O4

> <smiles.canonical>
O=C(O)CC1=CC(=CC=C1OCC)C=2C=CC=C(C2)CCCC3=NN(C(=O)N3CC)CC4=CC=C(C=C4)C(C)(C)C

> <molecular.weight>
555.71

> <boiling.point.predicted>
680.182±65.00 °C    Press: 760.00 Torr

> <density.predicted>
1.133±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
4.109±0.10    Most Acidic Temp: 25 °C

$$$$
