Name: [4-(Triphenylsilyl)phenyl]boronic acid
SKU: 852475-03-7

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Basic Information

Molecular Structure:
CAS No.:	852475-03-7
Name:	[4-(Triphenylsilyl)phenyl]boronic acid
Article Data:	14

Formula:	C₂₄H₂₁BO₂Si
Molecular Weight:	380.326
Synonyms:	4-phenylboronic acid triphenylsilane;
Density:	1.184 g/cm³
Boiling Point:	515.302 °C at 760 mmHg
Flash Point:	265.445 °C
PSA:	40.46000
LogP:	0.74380

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Specification

The CAS registry number of 4-(Triphenylsilyl)phenyl]boronic acid is 852475-03-7. This chemical's molecular formula is C₂₄H₂₁BO₂Si and molecular weight is 380.32. What's more, its IUPAC name is the same with its product name.

Physical properties about 4-(Triphenylsilyl)phenyl]boronic acid are: (1)ACD/LogP: 6.145; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.14; (4)ACD/LogD (pH 7.4): 6.09; (5)ACD/BCF (pH 5.5): 27487.10; (6)ACD/BCF (pH 7.4): 24257.78; (7)ACD/KOC (pH 5.5): 52348.41; (8)ACD/KOC (pH 7.4): 46198.26; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 40.46 Å²; (13)Index of Refraction: 1.643; (14)Molar Refractivity: 116.177 cm³; (15)Molar Volume: 321.165 cm³; (16)Polarizability: 46.056×10^-24cm³; (17)Surface Tension: 49.416 dyne/cm; (18)Density: 1.184 g/cm³; (19)Flash Point: 265.445 °C; (20)Enthalpy of Vaporization: 82.873 kJ/mol; (21)Boiling Point: 515.302 °C at 760 mmHg ; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1ccc(cc1)[Si](c2ccccc2)(c3ccccc3)c4ccccc4)(O)O
(2) InChI: InChI=1S/C24H21BO2Si/c26-25(27)20-16-18-24(19-17-20)28(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-19,26-27H
(3) InChIKey: PMOBXFBCSAQLOY-UHFFFAOYSA-N