N-(3,5-Dibromo-4-methylphenyl)glycine 2-[(2-hydroxy-5-nitrophenyl)methylene]h...
C16H14Br2N4O4
325970-71-6 Copyright (C) 2024 ACS
 26 27  0  0  0  0  0  0  0  0999 V2000
    6.1600    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9300    4.0011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    4.0011    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2400    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7800    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4700    6.6684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5500    6.6684    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    5.3347    0.0000 N   0  0  0  0  0  5  0  0  0  0  0  0
    2.3100    6.6684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1700    4.0011    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   16.1700    9.3358    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   17.7100    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8500    1.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100    1.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5400    2.6674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0900    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8600    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8600    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4000    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4000    8.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1700    6.6684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7 21  1  0  0  0  0
  8 17  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 18  1  0  0  0  0
 12 24  1  0  0  0  0
 13 25  1  0  0  0  0
 14 26  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 20  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
 24 26  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
> <cas.rn>
325970-71-6

> <cas.index.name>
Glycine, N-(3,5-dibromo-4-methylphenyl)-, 2-[(2-hydroxy-5-nitrophenyl)methylene]hydrazide

> <molecular.formula>
C16H14Br2N4O4

> <molecular.weight>
486.11

> <density.predicted>
1.791±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
5.654±0.30    Most Acidic Temp: 25 °C

$$$$
