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Basic Information
CAS No.: 445264-61-9
Name: 2-Methoxyl-5-pyridineboronic acid pinacol ester
Molecular Structure:
Molecular Structure of 445264-61-9 (2-Methoxyl-5-pyridineboronic acid pinacol ester)
Formula: C12H18BNO3
Molecular Weight: 235.091
Synonyms: 2-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;
Density: 1.067 g/cm3
Melting Point: 47-51 °C(lit.)
Boiling Point: 321.823 °C at 760 mmHg
Flash Point: 148.433 °C
Solubility: Soluble in water
Hazard Symbols: IrritantXi
Risk Codes: 36/38
Safety: 26
PSA: 40.58000
LogP: 1.38940
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    2-Methoxyl-5-pyridineboronic acid pinacol ester Application:powder or liquid

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Specification

The cas register number of 2-Methoxyl-5-pyridineboronic acid pinacol ester is 445264-61-9. It also can be called as 2-Methoxypyridine-5-boronic acid pinacol ester and the IUPAC Name about this chemical is 2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine. It belongs to the Chiral chemicals. This chemical is irritating to eyes and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Physical properties about 2-Methoxyl-5-pyridineboronic acid pinacol ester are: (1)#H bond acceptors: 4; (2)#Freely Rotating Bonds: 2; (3)Polar Surface Area: 40.58Å2; (4)Index of Refraction: 1.489; (5)Molar Refractivity: 63.621 cm3; (6)Molar Volume: 220.268 cm3; (7)Polarizability: 25.221x10-24cm3; (8)Surface Tension: 35.071 dyne/cm; (9)Enthalpy of Vaporization: 54.12 kJ/mol; (10)Boiling Point: 321.823 °C at 760 mmHg; (11)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2ccc(nc2)OC
(2)InChI: InChI=1/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-7-10(15-5)14-8-9/h6-8H,1-5H3
(3)InChIKey: QOGNDJLSYMJGPP-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-7-10(15-5)14-8-9/h6-8H,1-5H3
(5)Std. InChIKey: QOGNDJLSYMJGPP-UHFFFAOYSA-N