The 6-Fluoro-2-aminophenol with the cas number 53981-25-2 is also called 3-Fluoro-2-hydroxyaniline. The systematic name is 2-amino-6-fluorophenol. Its molecular formula is C6H6FNO. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 1.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.06; (4)ACD/LogD (pH 7.4): 1.03; (5)ACD/BCF (pH 5.5): 3.72; (6)ACD/BCF (pH 7.4): 3.53; (7)ACD/KOC (pH 5.5): 88.62; (8)ACD/KOC (pH 7.4): 83.94; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47Å2; (13)Index of Refraction: 1.601; (14)Molar Refractivity: 32.36 cm3; (15)Molar Volume: 94.3 cm3; (16)Polarizability: 12.83×10-24cm3; (17)Surface Tension: 53.5 dyne/cm; (18)Enthalpy of Vaporization: 47.04 kJ/mol ; (19)Vapour Pressure: 0.0996 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(N)c1O
(2)InChI: InChI=1/C13H12O3/c1-10-13(12(14)7-8-15-10)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3
(3)InChIKey: LQDVCPYRCOKNMV-UHFFFAOYAC
|