The 2-Fluoro-5-methoxyaniline with cas registry number of 62257-15-2, has systematic name of 2-fluoro-5-methoxyaniline. And it is also called benzenamine, 2-fluoro-5-methoxy-. The 2-Fluoro-5-methoxyaniline belongs to the following product categorie: variousamine.
Physical properties about this chemical are: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 5; (6)ACD/BCF (pH 7.4): 5; (7)ACD/KOC (pH 5.5): 113; (8)ACD/KOC (pH 7.4): 113; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.25 Å2; (13)Index of Refraction: 1.532; (14)Molar Refractivity: 37.161 cm3; (15)Molar Volume: 119.926 cm3; (16)Polarizability: 14.732×10-24cm3; (17)Surface Tension: 37.567 dyne/cm; (18)Enthalpy of Vaporization: 47.441 kJ/mol; (19)Vapour Pressure: 0.044 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cc(OC)ccc1F;
(2)InChI: InChI=1/C7H8FNO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,9H2,1H3;
(3)InChIKey: RUTKJXMYXZFXPQ-UHFFFAOYAI;
(4)Std. InChI: InChI=1S/C7H8FNO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,9H2,1H3;
(5)Std. InChIKey: RUTKJXMYXZFXPQ-UHFFFAOYSA-N.
|