2(1H)-Naphthalenone,3,4-dihydro-6-hydroxy- (52727-28-3)

The 6-Hydroxyl-2-tetralone, with the CAS registry number 1948-39-6 and EINECS registry number 52727-28-3, has the systematic name of 6-hydroxy-3,4-dihydronaphthalen-2(1H)-one. And the molecular formula of the chemical is C₁₀H₁₀O₂.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.99; (4)ACD/LogD (pH 7.4): 0.99; (5)ACD/BCF (pH 5.5): 3.33; (6)ACD/BCF (pH 7.4): 3.32; (7)ACD/KOC (pH 5.5): 82.31; (8)ACD/KOC (pH 7.4): 82.04; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.602; (14)Molar Refractivity: 45.05 cm³; (15)Molar Volume: 131.1 cm³; (16)Polarizability: 17.85×10^-24cm³; (17)Surface Tension: 52.4 dyne/cm; (18)Density: 1.236 g/cm³; (19)Flash Point: 150.6 °C; (20)Enthalpy of Vaporization: 62.19 kJ/mol; (21)Boiling Point: 353.3 °C at 760 mmHg; (22)Vapour Pressure: 1.77E-05 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C2Cc1c(cc(O)cc1)CC2
(2)InChI: InChI=1/C10H10O2/c11-9-3-1-7-5-10(12)4-2-8(7)6-9/h1,3,6,11H,2,4-5H2
(3)InChIKey: RRWJKWKHVNDLOY-UHFFFAOYAJ