4-[(1E)-2-(2-Chloro-6-fluorophenyl)ethenyl]-N-methylbenzenamine
C15H13ClFN
1391934-98-7 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  18 19 0 0 0
M  V30 BEGIN ATOM
M  V30 1 C 4.6200 2.6674 0.0 0
M  V30 2 C 5.3900 4.0011 0.0 0
M  V30 3 Cl 3.0800 5.3349 0.0 0
M  V30 4 F 3.0800 0.0000 0.0 0
M  V30 5 N 11.5500 4.0011 0.0 0
M  V30 6 C 12.3200 5.3349 0.0 0
M  V30 7 C 3.0800 2.6674 0.0 0
M  V30 8 C 2.3100 4.0011 0.0 0
M  V30 9 C 2.3100 1.3338 0.0 0
M  V30 10 C 0.7700 4.0011 0.0 0
M  V30 11 C 0.7700 1.3338 0.0 0
M  V30 12 C 0.0000 2.6674 0.0 0
M  V30 13 C 6.9300 4.0011 0.0 0
M  V30 14 C 7.7000 2.6674 0.0 0
M  V30 15 C 7.7000 5.3349 0.0 0
M  V30 16 C 9.2400 2.6674 0.0 0
M  V30 17 C 9.2400 5.3349 0.0 0
M  V30 18 C 10.0100 4.0011 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 1 2
M  V30 2 1 1 7
M  V30 3 1 2 13
M  V30 4 1 3 8
M  V30 5 1 4 9
M  V30 6 1 5 6
M  V30 7 1 5 18
M  V30 8 2 7 8
M  V30 9 1 7 9
M  V30 10 1 8 10
M  V30 11 2 9 11
M  V30 12 2 10 12
M  V30 13 1 11 12
M  V30 14 2 13 14
M  V30 15 1 13 15
M  V30 16 1 14 16
M  V30 17 2 15 17
M  V30 18 2 16 18
M  V30 19 1 17 18
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1391934-98-7

> <cas.index.name>
Benzenamine, 4-[(1E)-2-(2-chloro-6-fluorophenyl)ethenyl]-N-methyl-

> <molecular.formula>
C15H13ClFN

> <molecular.weight>
261.72

> <melting.point.experimental>
43-45 °C

> <boiling.point.predicted>
385.1±30.0 °C    Press: 760 Torr

> <density.predicted>
1.256±0.06 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
4.44±0.38    Most Basic Temp: 25 °C

$$$$
