CAS No.302554-81-0,9,9-Di-n-octylfluorene-2-boronic acid pinacol ester Suppliers

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Basic Information

Molecular Structure:
CAS No.:	302554-81-0
Name:	9,9-Di-n-octylfluorene-2-boronic acid pinacol ester
Article Data:	14

Formula:	C₃₅H₅₃BO₂
Molecular Weight:	516.616
Synonyms:	2-(9,9-Dioctylfluoren-2-yl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane;2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolane-2-yl)-9,9-dioctylfluorene;
EINECS:	805-568-0
Density:	0.994 g/cm³
Melting Point:	50-56 °C
Boiling Point:	606.328 °C at 760 mmHg
Flash Point:	320.496 °C
PSA:	18.46000
LogP:	9.75350

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Specification

The 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-dioctylfluorene, with the CAS registry number 302554-81-0, is also known as 1,3,2-Dioxaborolane, 2-(9,9-dioctyl-9H-fluoren-2-yl)-4,4,5,5-tetramethyl-. This chemical's molecular formula is C₃₅H₅₃BO₂ and molecular weight is 516.61. What's more, its systematic name is 2-(9,9-Dioctyl-9H-fluoren-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

Physical properties of 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-dioctylfluorene are: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 15; (4)Polar Surface Area: 18.46 Å²; (5)Index of Refraction: 1.531; (6)Molar Refractivity: 160.842 cm³; (7)Molar Volume: 519.497 cm³; (8)Polarizability: 63.763×10^-24cm³; (9)Surface Tension: 39.02 dyne/cm; (10)Density: 0.994 g/cm³; (11)Flash Point: 320.496 °C; (12)Enthalpy of Vaporization: 86.814 kJ/mol; (13)Boiling Point: 606.328 °C at 760 mmHg; (14)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O1B(OC(C)(C)C1(C)C)c4ccc3c2ccccc2C(c3c4)(CCCCCCCC)CCCCCCCC
(2)Std. InChI: InChI=1S/C35H53BO2/c1-7-9-11-13-15-19-25-35(26-20-16-14-12-10-8-2)31-22-18-17-21-29(31)30-24-23-28(27-32(30)35)36-37-33(3,4)34(5,6)38-36/h17-18,21-24,27H,7-16,19-20,25-26H2,1-6H3
(3)Std. InChIKey: VOASJDUTCQKQLE-UHFFFAOYSA-N