Name: 4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-1H-INDAZOLE
SKU: 885618-33-7

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Basic Information

Molecular Structure:
CAS No.:	885618-33-7
Name:	4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-1H-INDAZOLE

Formula:	C₁₃H₁₇BN₂O₂
Molecular Weight:	244.101
Synonyms:	4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole;1H-Indazol-4-ylboronic acid pinacol ester;
Density:	1.154 g/cm³
Melting Point:	139-142℃
Boiling Point:	404.123 °C at 760 mmHg
Flash Point:	198.207 °C
PSA:	47.14000
LogP:	1.86210

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Specification

The 1H-Indazol-4-ylboronic acid pinacol ester with the CAS number 885618-33-7 is also called 1H-Indazole,4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-. The systematic name is 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole. Its molecular formula is C₁₃H₁₇BN₂O₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 1H-Indazol-4-ylboronic acid pinacol ester are: (1)#H bond acceptors: 4; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 47.14 Å²; (5)Index of Refraction: 1.564; (6)Molar Refractivity: 68.738 cm³; (7)Molar Volume: 211.475 cm³; (8)Polarizability: 27.25×10^-24cm³; (9)Surface Tension: 43.683 dyne/cm; (10)Enthalpy of Vaporization: 63 kJ/mol; (11)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2cccc3c2cn[nH]3
(2)InChI: InChI=1/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)10-6-5-7-11-9(10)8-15-16-11/h5-8H,1-4H3,(H,15,16)
(3)InChIKey: YRPXZCWDXBNPBD-UHFFFAOYAQ