The Molecular Structure of Butanoic acid, 3-((5-(2-chloro-4-(trifluoromethyl)phenoxy)-2-nitrophenyl)amino)-, methyl ester (CAS NO.116929-00-1):
Molecular Formula: C18H16ClF3N2O5
Molecular Weight: 432.778250 g/mol
IUPAC: methyl 3-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitroanilino]butanoate
Index of Refraction: 1.558
Molar Refractivity: 98.99 cm3
Molar Volume: 306.6 cm3
Surface Tension: 43.3 dyne/cm
Density: 1.411 g/cm3
Flash Point: 246.8 °C
Enthalpy of Vaporization: 74.98 kJ/mol
Boiling Point: 484.5 °C at 760 mmHg
Vapour Pressure: 1.53E-09 mmHg at 25°C
Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx, Cl−, and Cl−.
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