3,4,5-TRIS(BENZYLOXY)BENZYL ALCOHOL

The Benzenemethanol, 3, 4, 5-tris(phenylmethoxy)-, with the CAS registry number 79831-88-2, is also known as 3, 4, 5-Tris(benzyloxy)benzyl Alcohol. This chemical's molecular formula is C₂₈H₂₆O₄ and molecular weight is 426.5. What's more, its systematic name is [3, 4, 5-Tris(benzyloxy)phenyl]methanol. In addition, it must be stored in airtight containers and placed in a dry, cool place. Meanwhile, it should be kept away from oxidant. The dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.

Physical properties about Benzenemethanol, 3, 4, 5-tris(phenylmethoxy)- are: (1)ACD/LogP: 5.44; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.44; (4)ACD/LogD (pH 7.4): 5.44; (5)ACD/BCF (pH 5.5): 8020.38; (6)ACD/BCF (pH 7.4): 8020.38; (7)ACD/KOC (pH 5.5): 21687.68 ; (8)ACD/KOC (pH 7.4): 21687.68; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 36.92 Å²; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 126.2 cm³; (15)Molar Volume: 357.3 cm³; (16)Polarizability: 50.03×10^-24 cm³; (17)Surface Tension: 49.3 dyne/cm; (18)Density: 1.193 g/cm³; (19)Flash Point: 317.8 °C; (20)Enthalpy of Vaporization: 94.16 kJ/mol; (21)Boiling Point: 601.8 °C at 760 mmHg; (22)Vapour Pressure: 2.47E-15 mmHg at 25 °C.

Preparation of Benzenemethanol, 3, 4, 5-tris(phenylmethoxy)-: this chemical is prepared by 3, 4, 5-Tris-benzyloxy-benzoic acid methyl ester. The reaction needs reagent LiAlH₄ and solvent Tetrahydrofuran. The reaction time is 1.5 hours with reaction temperature of 0 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(c3c(OCc1ccccc1)cc(cc3OCc2ccccc2)CO)Cc4ccccc4
(2) InChI: InChI=1/C28H26O4/c29-18-25-16-26(30-19-22-10-4-1-5-11-22)28(32-21-24-14-8-3-9-15-24)27(17-25)31-20-23-12-6-2-7-13-23/h1-17,29H,18-21H2
(3) InChIKey: FWPHSYJOSSBILN-UHFFFAOYAA