4-[4-(Methylamino)imidazo[1,2-a]quinoxalin-1-yl]-1,2-benzenediol
C17H14N4O2
1958290-51-1 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  23 26 0 0 0
M  V30 BEGIN ATOM
M  V30 1 N 11.1711 5.3901 0.0 0
M  V30 2 C 12.5047 4.6201 0.0 0
M  V30 3 O 0.9517 7.2991 0.0 0
M  V30 4 O 0.0000 4.3698 0.0 0
M  V30 5 N 7.1699 4.6201 0.0 0
M  V30 6 C 6.0255 5.6505 0.0 0
M  V30 7 C 8.5036 5.3901 0.0 0
M  V30 8 C 7.1699 3.0801 0.0 0
M  V30 9 C 6.6518 7.0575 0.0 0
M  V30 10 C 9.8374 4.6201 0.0 0
M  V30 11 N 8.1834 6.8964 0.0 0
M  V30 12 C 8.5036 2.3100 0.0 0
M  V30 13 C 5.8362 2.3100 0.0 0
M  V30 14 N 9.8374 3.0801 0.0 0
M  V30 15 C 8.5036 0.7700 0.0 0
M  V30 16 C 5.8362 0.7700 0.0 0
M  V30 17 C 7.1699 0.0000 0.0 0
M  V30 18 C 4.5191 5.3303 0.0 0
M  V30 19 C 3.4886 6.4749 0.0 0
M  V30 20 C 4.0432 3.8658 0.0 0
M  V30 21 C 1.9822 6.1547 0.0 0
M  V30 22 C 2.5369 3.5456 0.0 0
M  V30 23 C 1.5063 4.6900 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2
M  V30 2 1 1 10
M  V30 3 1 3 21
M  V30 4 1 4 23
M  V30 5 1 5 6
M  V30 6 1 5 7
M  V30 7 1 5 8
M  V30 8 2 6 9
M  V30 9 1 6 18
M  V30 10 1 7 10
M  V30 11 2 7 11
M  V30 12 1 8 12
M  V30 13 2 8 13
M  V30 14 1 9 11
M  V30 15 2 10 14
M  V30 16 1 12 14
M  V30 17 2 12 15
M  V30 18 1 13 16
M  V30 19 1 15 17
M  V30 20 2 16 17
M  V30 21 2 18 19
M  V30 22 1 18 20
M  V30 23 1 19 21
M  V30 24 2 20 22
M  V30 25 2 21 23
M  V30 26 1 22 23
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
1958290-51-1

> <cas.index.name>
1,2-Benzenediol, 4-[4-(methylamino)imidazo[1,2-a]quinoxalin-1-yl]-

> <molecular.formula>
C17H14N4O2

> <molecular.weight>
306.32

> <boiling.point.predicted>
559.1±50.0 °C    Press: 760 Torr

> <density.predicted>
1.45±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
9.17±0.20    Most Acidic Temp: 25 °C

$$$$
