The 2-Chloro-4-fluoro-5-methylaniline, with its CAS registry number 116759-33-2, has the IUPAC name of 4-chloro-2-fluoro-5-methylaniline. It has the molecular foumula of C₇H₇ClFN and the formula weight of 159.59. When comes to its usage, it is often applied as the intermediate in pharmaceuticals, pesticides and liquid crystal materials.
 
The characteristics of 2-Chloro-4-fluoro-5-methylaniline are as follows: (1)ACD/LogP: 2.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.14; (4)ACD/LogD (pH 7.4): 2.14; (5)ACD/BCF (pH 5.5): 24.95; (6)ACD/BCF (pH 7.4): 25; (7)ACD/KOC (pH 5.5): 347.84; (8)ACD/KOC (pH 7.4): 348.58; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Ų; (13)Index of Refraction: 1.561; (14)Molar Refractivity: 40.2 cm³; (15)Molar Volume: 124.1 cm³; (16)Polarizability: 15.93×10^-24cm³; (17)Surface Tension: 40.7 dyne/cm; (18)Density: 1.285 g/cm³; (19)Flash Point: 89.4 °C; (20)Enthalpy of Vaporization: 46.07 kJ/mol; (21)Boiling Point: 224.2 °C at 760 mmHg; (22)Vapour Pressure: 0.0925 mmHg at 25°C; (23)Exact Mass: 159.025105; (24)MonoIsotopic Mass: 159.025105; (25)Topological Polar Surface Area: 26; (26)Heavy Atom Count: 10; (27)Complexity: 120.

What's more, the following datas could be converted into the molecular structure:
(1)Canonical SMILES: CC1=CC(=C(C=C1Cl)F)N
(2)InChI: InChI=1S/C7H7ClFN/c1-4-2-7(10)6(9)3-5(4)8/h2-3H,10H2,1H3
(3)InChIKey: KENAMMSVUHVEOL-UHFFFAOYSA-N