Molecular Structure of 3-Bromo-2-nitroaniline (CAS No.7138-15-0):
Molecular Formula: C6H5BrN2O2
Molecular Weight: 217.02
IUPAC Name: 3-Bromo-2-nitroaniline
CAS No: 7138-15-0
H bond acceptors: 4
H bond donors: 2
Freely Rotating Bonds: 2
Polar Surface Area: 71.84 Å2
Index of Refraction: 1.669
Molar Refractivity: 44.72 cm3
Molar Volume: 119.7 cm3
Surface Tension: 64.3 dyne/cm
Density: 1.812 g/cm3
Flash Point: 134.3 °C
Enthalpy of Vaporization: 53.83 kJ/mol
Boiling Point: 298.4 °C at 760 mmHg
Vapour Pressure: 0.00127 mmHg at 25°C
InChI: InChI=1/C6H5BrN2O2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H,8H2
InChIKey: GLKHLBAXHLAQBJ-UHFFFAOYAQ
Std. InChI: InChI=1S/C6H5BrN2O2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H,8H2
Std. InChIKey: GLKHLBAXHLAQBJ-UHFFFAOYSA-N
3-Bromo-2-nitroaniline (CAS No.7138-15-0), it also can be called Benzenamine, 3-bromo-2-nitro- ; 2-Amino-6-bromonitrobenzene .
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