Clomipramine
C19H23ClN2
303-49-1 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  22 24 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 5.2067 4.1478 0.0 0
M  V30 2 C 6.5404 4.9178 0.0 0
M  V30 3 C 7.8740 4.1478 0.0 0
M  V30 4 N 9.2079 4.9178 0.0 0
M  V30 5 C 10.5415 4.1478 0.0 0
M  V30 6 C 9.2079 6.4578 0.0 0
M  V30 7 Cl 2.1570 0.0000 0.0 0
M  V30 8 N 3.8730 4.9178 0.0 0
M  V30 9 C 2.6005 4.0503 0.0 0
M  V30 10 C 3.9881 6.4535 0.0 0
M  V30 11 C 1.1290 4.5043 0.0 0
M  V30 12 C 2.9432 2.5489 0.0 0
M  V30 13 C 2.8591 7.5010 0.0 0
M  V30 14 C 5.4597 6.9075 0.0 0
M  V30 15 C 0.5663 5.9379 0.0 0
M  V30 16 C 0.0000 3.4568 0.0 0
M  V30 17 C 1.8143 1.5014 0.0 0
M  V30 18 C 1.3363 7.2716 0.0 0
M  V30 19 C 3.2019 9.0024 0.0 0
M  V30 20 C 5.8024 8.4089 0.0 0
M  V30 21 C 0.3427 1.9554 0.0 0
M  V30 22 C 4.6734 9.4564 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 8
M  V30 3 1 2 3
M  V30 4 1 3 4
M  V30 5 1 4 5
M  V30 6 1 4 6
M  V30 7 1 7 17
M  V30 8 1 8 9
M  V30 9 1 8 10
M  V30 10 1 9 11
M  V30 11 2 9 12
M  V30 12 1 10 13
M  V30 13 2 10 14
M  V30 14 1 11 15
M  V30 15 2 11 16
M  V30 16 1 12 17
M  V30 17 1 13 18
M  V30 18 2 13 19
M  V30 19 1 14 20
M  V30 20 1 15 18
M  V30 21 1 16 21
M  V30 22 2 17 21
M  V30 23 1 19 22
M  V30 24 2 20 22
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
303-49-1

> <cas.index.name>
5H-Dibenz[b,f]azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-

> <molecular.formula>
C19H23ClN2

> <molecular.weight>
314.85

> <melting.point.experimental>
189.5 °C

> <boiling.point.experimental>
160-170 °C    Press: 0.03 Torr

> <density.predicted>
1.119±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
9.46±0.28    Most Basic Temp: 25 °C

$$$$
