[2,4′-Bipyridin]-3-yl[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]methanone
C23H23N3O2
1429505-03-2 Copyright (C) 2024 ACS
 28 31  0  0  0  0  0  0  0  0999 V2000
    5.3900    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    5.3347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1898    3.0112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1898    4.9910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    1.3338    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3900    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0800    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    6.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    6.6685    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9300    4.0011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7000    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2400    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2400    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0100    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6369    3.5378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9043    5.0546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8166    2.5481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3514    5.5813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2637    3.0748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5312    4.5914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 17  1  0  0  0  0
  3 22  1  0  0  0  0
  3 23  1  0  0  0  0
  4 22  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  5 11  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 10  2  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  2  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 16  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 22  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 26 28  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
> <cas.rn>
1429505-03-2

> <cas.index.name>
Methanone, [2,4′-bipyridin]-3-yl[4-hydroxy-4-(phenylmethyl)-1-piperidinyl]-

> <molecular.formula>
C23H23N3O2

> <molecular.weight>
373.45

> <boiling.point.predicted>
597.366±50.00 °C    Press: 760.00 Torr

> <density.predicted>
1.245±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
14.436±0.20    Most Acidic Temp: 25 °C

$$$$
