N,N′-1,2-Ethanediylbis[2-[4-(1,1-dimethylethyl)phenoxy]acetamide]
C26H36N2O4
494830-67-0 Copyright (C) 2025 ACS
 32 33  0  0  0  0  0  0  0  0999 V2000
    1.5400    8.2085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    9.7485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.2085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    6.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000    8.2085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    6.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100    6.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    5.5411    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    8.2085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3200    5.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0900    4.2074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6300    4.2074    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4000    2.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9400    2.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6300    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7100    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.8700    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8700    3.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4100    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8700    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    8.2085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    6.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    9.5421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    6.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    9.5421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1600    8.2085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2500    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0200    0.2064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0200    2.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5600    0.2064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5600    2.8738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3300    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1 21  1  0  0  0  0
  5  6  1  0  0  0  0
  5 26  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 27  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
 17 32  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
 24 26  2  0  0  0  0
 25 26  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
 28 30  1  0  0  0  0
 29 31  2  0  0  0  0
 30 32  2  0  0  0  0
 31 32  1  0  0  0  0
M  END
> <cas.rn>
494830-67-0

> <ca.index.name>
Acetamide, N,N′-1,2-ethanediylbis[2-[4-(1,1-dimethylethyl)phenoxy]-

> <molecular.formula>
C26H36N2O4

> <smiles.canonical>
O=C(NCCNC(=O)COC1=CC=C(C=C1)C(C)(C)C)COC2=CC=C(C=C2)C(C)(C)C

> <molecular.weight>
440.58

> <boiling.point.predicted>
673.351±55.00 °C    Press: 760.00 Torr

> <density.predicted>
1.076±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
13.785±0.46    Most Acidic Temp: 25 °C

$$$$
