Serotonin
C10H12N2O
50-67-9 Copyright (C) 2025 ACS
 13 14  0  0  0  0  0  0  0  0999 V2000
    5.7308    1.9571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1955    2.4329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3399    1.4025    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0801    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3101    4.0012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5864    2.9877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3101    1.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3405    5.1456    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    4.0012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7473    4.5192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7700    1.3337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.6673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  2  3  1  0  0  0  0
  4 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  8  2  0  0  0  0
  6  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 12 13  2  0  0  0  0
M  END
> <cas.rn>
50-67-9

> <cas.index.name>
1H-Indol-5-ol, 3-(2-aminoethyl)-

> <molecular.formula>
C10H12N2O

> <molecular.weight>
176.22

> <melting.point.experimental>
167.5 °C

> <boiling.point.predicted>
416.089±30.00 °C    Press: 760.00 Torr

> <density.predicted>
1.288±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
10.093±0.40    Most Acidic Temp: 25 °C

$$$$
