Molecular Structure of 5-bromo-4-(trifluoromethyl)pyridin-2-amine (CAS NO.944401-56-3):
Empirical Formula: C6H4BrF3N2
Molecular Weight: 241.0086
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 0
Polar Surface Area: 38.91Å2
Index of Refraction: 1.524
Molar Refractivity: 41.25 cm3
Molar Volume: 134.6 cm3
Surface Tension: 38.3 dyne/cm
Density: 1.79 g/cm3
Flash Point: 101.3 °C
Enthalpy of Vaporization: 48.1 kJ/mol
Boiling Point: 243.9 °C at 760 mmHg
Vapour Pressure: 0.0312 mmHg at 25°C
SMILES: c1c(c(cnc1N)Br)C(F)(F)F
InChI: InChI=1/C6H4BrF3N2/c7-4-2-12-5(11)1-3(4)6(8,9)10/h1-2H,(H2,11,12)
HazardClass: Irritant
5-bromo-4-(trifluoromethyl)pyridin-2-amine , with CAS number of 944401-56-3, can be called 2-pyridinamine, 5-bromo-4-(trifluoromethyl)- .
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