4-Amino-2-chloro-3-fluorophenol (1003710-18-6)

The CAS register number of 4-Amino-2-chloro-3-fluorophenol is 1003710-18-6. It also can be called as Phenol, 4-amino-2-chloro-3-fluoro- and the systematic name about this chemical is 4-amino-2-chloro-3-fluorophenol.

Physical properties about 4-Amino-2-chloro-3-fluorophenol are: (1)ACD/LogP: 1.39; (2)ACD/LogD (pH 5.5): 1.39; (3)ACD/LogD (pH 7.4): 1.24; (4)ACD/BCF (pH 5.5): 6.7; (5)ACD/BCF (pH 7.4): 4.77; (6)ACD/KOC (pH 5.5): 135.55; (7)ACD/KOC (pH 7.4): 96.55; (8)#H bond acceptors: 2; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 46.25Ų; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 37.25 cm³; (14)Molar Volume: 106.3 cm³; (15)Polarizability: 14.77x10^-24cm³; (16)Surface Tension: 56.2 dyne/cm; (17)Enthalpy of Vaporization: 54.6 kJ/mol; (18)Boiling Point: 285.9 °C at 760 mmHg; (19)Vapour Pressure: 0.00158 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1ccc(O)c(Cl)c1F
(2)InChI: InChI=1/C6H5ClFNO/c7-5-4(10)2-1-3(9)6(5)8/h1-2,10H,9H2
(3)InChIKey: FEIRBFCWDDTCEQ-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C6H5ClFNO/c7-5-4(10)2-1-3(9)6(5)8/h1-2,10H,9H2
(5)Std. InChIKey: FEIRBFCWDDTCEQ-UHFFFAOYSA-N