Boronic acid,B-[2-[(1,1-dimethylethoxy)methyl]phenyl]- (373384-12-4)

The 2-(tert-Butoxymethyl)phenylboronic acid with cas registry number of 373384-12-4, belongs to the following product categories: (1)BORONICACID; (2)Alkoxy; (3)Aryl; (4)Organoborons. It has the systematic name of [2-(tert-butoxymethyl)phenyl]boronic acid. And it is also named (2-{[(2-Methyl-2-propanyl)oxy]methyl}phenyl)boronic acid.

Physical properties about this chemical are: (1)ACD/LogP: 2.56; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 27.69 Å²; (7)Index of Refraction: 1.506; (8)Molar Refractivity: 58.18 cm³; (9)Molar Volume: 195.6 cm³; (10)Polarizability: 23.06×10^-24cm³; (11)Surface Tension: 38.3 dyne/cm; (12)Enthalpy of Vaporization: 61.13 kJ/mol; (13)Vapour Pressure: 4.52E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(C(C)(C)C)Cc1ccccc1B(O)O;
(2)InChI: InChI=1/C11H17BO3/c1-11(2,3)15-8-9-6-4-5-7-10(9)12(13)14/h4-7,13-14H,8H2,1-3H3;
(3)InChIKey: MKTUWARSDLQBAL-UHFFFAOYAX;
(4)Std. InChI: InChI=1S/C11H17BO3/c1-11(2,3)15-8-9-6-4-5-7-10(9)12(13)14/h4-7,13-14H,8H2,1-3H3;
(5)Std. InChIKey: MKTUWARSDLQBAL-UHFFFAOYSA-N