N-[(2R)-2-(Dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
C17H18F2N2O
2771208-83-2 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  22 23 0 0 1
M  V30 BEGIN ATOM
M  V30 1 C 4.0010 3.8501 0.0 0 CFG=1
M  V30 2 C 5.3348 4.6201 0.0 0
M  V30 3 N 4.0010 2.3101 0.0 0
M  V30 4 N 6.6685 3.8501 0.0 0
M  V30 5 C 2.6673 1.5400 0.0 0
M  V30 6 C 5.3348 1.5400 0.0 0
M  V30 7 C 8.0022 4.6201 0.0 0
M  V30 8 O 8.0022 6.1601 0.0 0
M  V30 9 F 10.6697 0.0000 0.0 0
M  V30 10 F 13.3370 4.6201 0.0 0
M  V30 11 C 2.6673 4.6201 0.0 0
M  V30 12 C 2.6673 6.1601 0.0 0
M  V30 13 C 1.3337 3.8501 0.0 0
M  V30 14 C 1.3337 6.9302 0.0 0
M  V30 15 C 0.0000 4.6201 0.0 0
M  V30 16 C 0.0000 6.1601 0.0 0
M  V30 17 C 9.3360 3.8501 0.0 0
M  V30 18 C 9.3360 2.3101 0.0 0
M  V30 19 C 10.6697 4.6201 0.0 0
M  V30 20 C 10.6697 1.5400 0.0 0
M  V30 21 C 12.0033 3.8501 0.0 0
M  V30 22 C 12.0033 2.3101 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 3 CFG=3
M  V30 3 1 1 11
M  V30 4 1 2 4
M  V30 5 1 3 5
M  V30 6 1 3 6
M  V30 7 1 4 7
M  V30 8 2 7 8
M  V30 9 1 7 17
M  V30 10 1 9 20
M  V30 11 1 10 21
M  V30 12 2 11 12
M  V30 13 1 11 13
M  V30 14 1 12 14
M  V30 15 2 13 15
M  V30 16 2 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 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(1 1)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
> <cas.rn>
2771208-83-2

> <cas.index.name>
Benzamide, N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluoro-

> <molecular.formula>
C17H18F2N2O

> <molecular.weight>
304.34

> <boiling.point.predicted>
389.4±42.0 °C    Press: 760 Torr

> <density.predicted>
1.186±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
13.14±0.46    Most Acidic Temp: 25 °C

$$$$
