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1052714-68-7

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Basic Information
CAS No.: 1052714-68-7
Name: 3-PYRIDINAMINE, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-
Molecular Structure:
Molecular Structure of 1052714-68-7 (3-PYRIDINAMINE, 4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-)
Formula: C11H17BN2O2
Molecular Weight: 220.079
Synonyms: 3-pyridinamine, 4-(4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolan-2-yl)-;
Density: 1.093 g/cm3
Boiling Point: 371.292 °C at 760 mmHg
Flash Point: 178.351 °C
PSA: 57.37000
LogP: 1.54420
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Specification

The 3-Aminopyridine-4-boronic acid pinacol ester, with the CAS registry number 1052714-68-7, is also known as 3-pyridinamine, 4-(4, 4, 5, 5-tetramethyl-1, 3, 2-dioxaborolan-2-yl)-. This chemical's molecular formula is C11H17BN2O2 and molecular weight is 220.07588. What's more, its systematic name is 4-(4, 4, 5, 5-Tetramethyl-1, 3, 2-dioxaborolan-2-yl)pyridin-3-amine.

Physical properties about 3-Aminopyridine-4-boronic acid pinacol ester are: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 57.37 Å2; (5)Index of Refraction: 1.516; (6)Molar Refractivity: 60.873 cm3; (7)Molar Volume: 201.433 cm3; (8)Polarizability: 24.132×10-24 cm3; (9)Surface Tension: 39.618 dyne/cm; (10)Density: 1.093 g/cm3; (11)Flash Point: 178.351 °C; (12)Enthalpy of Vaporization: 61.829 kJ/mol; (13)Boiling Point: 371.292 °C at 760 mmHg; (14)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)c2ccncc2N
(2) InChI: InChI=1/C11H17BN2O2/c1-10(2)11(3,4)16-12(15-10)8-5-6-14-7-9(8)13/h5-7H,13H2,1-4H3
(3) InChIKey: WBUYZODHRBEOFK-UHFFFAOYAI