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195062-61-4

Basic Information
CAS No.: 195062-61-4
Name: 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)CHLOROBENZENE
Article Data: 107
Molecular Structure:
Molecular Structure of 195062-61-4 (4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)CHLOROBENZENE)
Formula: C12H16BClO2
Molecular Weight: 238.522
Synonyms: 2-(4-Chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)chlorobenzene;
Density: 1.103 g/cm3
Melting Point: 50-55 °C(lit.)
Boiling Point: 308.678 °C at 760 mmHg
Flash Point: 140.484 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22
Safety: 36
PSA: 18.46000
LogP: 2.63920
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  • 4-Chlorophenylboronic acid pinacol ester

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    195062-61-4

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    195062-61-4

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Specification

The 1,3,2-Dioxaborolane,2-(4-chlorophenyl)-4,4,5,5-tetramethyl-, with the CAS registry number 195062-61-4, has the systematic name of 2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. And the molecular formula of this chemical is C12H16BClO2. In addition, it is harmful if swallowed, and while dealing with it, you should wear suitable protective clothing.

The physical properties of 1,3,2-Dioxaborolane,2-(4-chlorophenyl)-4,4,5,5-tetramethyl- are as following: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 18.46 Å2; (5)Index of Refraction: 1.506; (6)Molar Refractivity: 64.284 cm3; (7)Molar Volume: 216.324 cm3; (8)Polarizability: 25.484×10-24cm3; (9)Surface Tension: 33.132 dyne/cm; (10)Density: 1.103 g/cm3; (11)Flash Point: 140.484 °C; (12)Enthalpy of Vaporization: 52.745 kJ/mol; (13)Boiling Point: 308.678 °C at 760 mmHg; (14)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(B1OC(C)(C)C(O1)(C)C)cc2
(2)InChI: InChI=1/C12H16BClO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,1-4H3
(3)InChIKey: NYARTXMDWRAVIX-UHFFFAOYAP