Following is the structure of 3-Amino-6-chloropyrazine-2-carboxylic acid (CAS NO.2727-13-1):
Empirical Formula: C5H4ClN3O2
Molecular Weight: 173.5572
Index of Refraction: 1.673
Molar Refractivity: 38.497 cm3
Molar Volume: 102.641 cm3
Density: 1.691 g/cm3
Flash Point: 197.024 °C
Surface Tension: 93.766 dyne/cm
Enthalpy of Vaporization: 68.891 kJ/mol
Boiling Point: 402.167 °C at 760 mmHg
SMILES: O=C(O)c1nc(Cl)cnc1N
InChI: InChI=1/C5H4ClN3O2/c6-2-1-8-4(7)3(9-2)5(10)11/h1H,(H2,7,8)(H,10,11)
InChIKey: TZEPSUWOCPVNMM-UHFFFAOYAB
3-Amino-6-chloropyrazine-2-carboxylic acid , its cas register number is 2727-13-1. It also can be called 2-Pyrazinecarboxylic acid, 3-amino-6-chloro- .
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