Ethyl 1-[3-(2-chlorophenyl)-1-oxopropyl]-3-piperidinecarboxylate
C17H22ClNO3
1211379-56-4 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  22 23 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 6.6685 3.0800 0.0 0
M  V30 2 C 5.3347 2.3100 0.0 0
M  V30 3 O 6.6685 4.6200 0.0 0
M  V30 4 C 4.0011 3.0800 0.0 0
M  V30 5 C 12.0032 3.0800 0.0 0
M  V30 6 O 13.3369 2.3100 0.0 0
M  V30 7 O 12.0032 4.6200 0.0 0
M  V30 8 C 14.6705 3.0800 0.0 0
M  V30 9 C 16.0043 2.3100 0.0 0
M  V30 10 Cl 1.3338 4.6200 0.0 0
M  V30 11 N 8.0021 2.3100 0.0 0
M  V30 12 C 9.3358 3.0800 0.0 0
M  V30 13 C 8.0021 0.7700 0.0 0
M  V30 14 C 10.6696 2.3100 0.0 0
M  V30 15 C 9.3358 0.0000 0.0 0
M  V30 16 C 10.6696 0.7700 0.0 0
M  V30 17 C 2.6674 2.3100 0.0 0
M  V30 18 C 1.3338 3.0800 0.0 0
M  V30 19 C 2.6674 0.7700 0.0 0
M  V30 20 C 0.0000 2.3100 0.0 0
M  V30 21 C 1.3338 0.0000 0.0 0
M  V30 22 C 0.0000 0.7700 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 2 1 3
M  V30 3 1 1 11
M  V30 4 1 2 4
M  V30 5 1 4 17
M  V30 6 1 5 6
M  V30 7 2 5 7
M  V30 8 1 5 14
M  V30 9 1 6 8
M  V30 10 1 8 9
M  V30 11 1 10 18
M  V30 12 1 11 12
M  V30 13 1 11 13
M  V30 14 1 12 14
M  V30 15 1 13 15
M  V30 16 1 14 16
M  V30 17 1 15 16
M  V30 18 2 17 18
M  V30 19 1 17 19
M  V30 20 1 18 20
M  V30 21 2 19 21
M  V30 22 2 20 22
M  V30 23 1 21 22
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1211379-56-4

> <cas.index.name>
3-Piperidinecarboxylic acid, 1-[3-(2-chlorophenyl)-1-oxopropyl]-, ethyl ester

> <molecular.formula>
C17H22ClNO3

> <molecular.weight>
323.82

> <boiling.point.predicted>
468.1±45.0 °C    Press: 760 Torr

> <density.predicted>
1.190±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
-1.64±0.40    Most Basic Temp: 25 °C

$$$$
