Cuprizone
C14H22N4O2
370-81-0 Copyright (C) 2024 ACS
 20 21  0  0  0  0  0  0  0  0999 V2000
    4.0010    2.3101    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3348    3.0801    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6685    2.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022    3.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6685    0.7700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3358    2.3101    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022    4.6201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6697    3.0801    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    3.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6673    4.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3337    2.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3337    5.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0033    2.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3370    3.0801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0033    0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6707    2.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3370    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6707    0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8 15  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <cas.rn>
370-81-0

> <cas.index.name>
Ethanedioic acid, 1,2-bis(2-cyclohexylidenehydrazide)

> <molecular.formula>
C14H22N4O2

> <molecular.weight>
278.35

> <density.predicted>
1.298±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
10.784±0.20    Most Acidic Temp: 25 °C

$$$$
