3-Pyridinecarboxylic acid, hydrochloride (1:1)
C6H5NO2.ClH
636-79-3 Copyright (C) 2025 ACS
 10  9  0  0  0  0  0  0  0  0999 V2000
    0.7700    2.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3101    2.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0801    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0801    4.2073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    1.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6201    4.2073    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3901    2.8737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6951    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8  9  2  0  0  0  0
M  END
> <cas.rn>
636-79-3

> <ca.index.name>
3-Pyridinecarboxylic acid, hydrochloride (1:1)

> <molecular.formula>
C6H5NO2.ClH

> <smiles.canonical>
Cl.O=C(O)C=1C=NC=CC1

> <molecular.weight>
159.57

> <melting.point.experimental>
250-255 °C

$$$$
