Benzeneethanol, 3-fluoro- (52059-53-7)

The 3-Fluorophenethyl alcohol, with the cas registry number 52059-53-7, has the systematic name of 2-(3-fluorophenyl)ethanol. Tts product categories are various, including Phenyls & Phenyl-Het; Phenyls & Phenyl-Het; Alcohols; C7 to C8; Oxygen Compounds. The molecular formula of the chemical is C₈H₉FO.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.41; (4)ACD/LogD (pH 7.4): 1.41; (5)ACD/BCF (pH 5.5): 6.95; (6)ACD/BCF (pH 7.4): 6.95; (7)ACD/KOC (pH 5.5): 139.46; (8)ACD/KOC (pH 7.4): 139.46; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 37.33 cm³; (15)Molar Volume: 123.9 cm³; (16)Polarizability: 14.79×10^-24cm³; (17)Surface Tension: 37.9 dyne/cm; (18)Density: 1.13 g/cm³; (19)Flash Point: 96.5 °C; (20)Enthalpy of Vaporization: 46.62 kJ/mol; (21)Boiling Point: 204.7 °C at 760 mmHg; (22)Vapour Pressure: 0.157 mmHg at 25°C.

You should be cautious while dealing with this chemical. It is harmful by inhalation and if swallowed, and it irritates to eyes, respiratory system and skin, what's more, it may cause burns. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice, and remeber to take off immediately all contaminated clothing.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1cc(ccc1)CCO
(2)InChI: InChI=1/C8H9FO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6,10H,4-5H2
(3)InChIKey: MZNBGEKFZCWVES-UHFFFAOYAH