Eslicarbazepine
C15H14N2O2
104746-04-5 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  19 21 0 0 1
M  V30 BEGIN ATOM
M  V30 1 C 3.5288 6.4632 0.0 0
M  V30 2 N 4.6577 7.5107 0.0 0
M  V30 3 O 2.0572 6.9172 0.0 0
M  V30 4 O 3.5288 0.0000 0.0 0
M  V30 5 C 2.6673 4.0016 0.0 0
M  V30 6 N 3.8715 4.9618 0.0 0
M  V30 7 C 2.6673 2.4616 0.0 0
M  V30 8 C 1.3337 4.7716 0.0 0
M  V30 9 C 5.3729 4.6192 0.0 0
M  V30 10 C 3.8715 1.5014 0.0 0 CFG=1
M  V30 11 C 1.3337 1.6916 0.0 0
M  V30 12 C 0.0000 4.0016 0.0 0
M  V30 13 C 6.0411 3.2316 0.0 0
M  V30 14 C 6.2404 5.8915 0.0 0
M  V30 15 C 5.3729 1.8440 0.0 0
M  V30 16 C 0.0000 2.4616 0.0 0
M  V30 17 C 7.5768 3.1166 0.0 0
M  V30 18 C 7.7761 5.7765 0.0 0
M  V30 19 C 8.4443 4.3889 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 6
M  V30 4 1 10 4 CFG=3
M  V30 5 1 5 6
M  V30 6 1 5 7
M  V30 7 2 5 8
M  V30 8 1 6 9
M  V30 9 1 7 10
M  V30 10 2 7 11
M  V30 11 1 8 12
M  V30 12 1 9 13
M  V30 13 2 9 14
M  V30 14 1 10 15
M  V30 15 1 11 16
M  V30 16 2 12 16
M  V30 17 1 13 15
M  V30 18 2 13 17
M  V30 19 1 14 18
M  V30 20 1 17 19
M  V30 21 2 18 19
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(1 10)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
> <cas.rn>
104746-04-5

> <cas.index.name>
5H-Dibenz[b,f]azepine-5-carboxamide, 10,11-dihydro-10-hydroxy-, (10S)-

> <molecular.formula>
C15H14N2O2

> <molecular.weight>
254.28

> <boiling.point.predicted>
431.3±55.0 °C    Press: 760 Torr

> <density.predicted>
1.336±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
13.75±0.20    Most Acidic Temp: 25 °C

$$$$
