Phenol,4-[(tetrahydro-2H-pyran-2-yl)oxy]- (53936-56-4)

The Deoxyarbutin, with the cas registry number 53936-56-4, has the systematic name of 4-(tetrahydro-2H-pyran-2-yloxy)phenol. And the molecular fomula of the chemical is C₁₁H₁₄O₃.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.50; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 38.69 Å²; (7)Index of Refraction: 1.552; (8)Molar Refractivity: 52.841 cm³; (9)Molar Volume: 165.414 cm³; (10)Polarizability: 20.948×10^-24cm³; (11)Surface Tension: 46.085 dyne/cm; (12)Density: 1.174 g/cm³; (13)Flash Point: 165.341 °C; (14)Enthalpy of Vaporization: 61.778 kJ/mol; (15)Boiling Point: 349.779 °C at 760 mmHg; (16)Vapour Pressure: 0 mmHg at 25°C.
 
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c1ccc(O)cc1)C2OCCCC2
(2)InChI: InChI=1/C11H14O3/c12-9-4-6-10(7-5-9)14-11-3-1-2-8-13-11/h4-7,11-12H,1-3,8H2
(3)InChIKey: GFBCWCDNXDKFRH-UHFFFAOYAE