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CAS No.: | 1073371-81-9 |
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Name: | 2-BENZYLOXY-3-(4,4,5,5-TETRAMETHYL-[1,3,2]-DIOXABOROLAN-2-YL)PYRIDINE |
Molecular Structure: | |
Formula: | C18H22BNO3 |
Molecular Weight: | 311.189 |
Synonyms: | Pyridine, 2-(phenylmethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-;2-Benzyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; |
Density: | 1.11 g/cm3 |
Boiling Point: | 436.4 °C at 760 mmHg |
Flash Point: | 217.8 °C |
Hazard Symbols: | T |
Risk Codes: | 25 |
Safety: | 45 |
PSA: | 40.58000 |
LogP: | 2.95980 |
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The 2-Benzyloxypyridine-3-boronic acid pinacol ester, with the CAS registry number 1073371-81-9, is also known as Pyridine, 2-(phenylmethoxy)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-. This chemical's molecular formula is C18H22BNO3 and molecular weight is 311.18. What's more, its systematic name is 2-benzyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine.
Physical properties of 2-Benzyloxypyridine-3-boronic acid pinacol ester are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 40.58 Å2; (5)Index of Refraction: 1.544; (6)Molar Refractivity: 88.33 cm3; (7)Molar Volume: 279.6 cm3; (8)Polarizability: 35.01×10-24cm3; (9)Surface Tension: 41.5 dyne/cm; (10)Density: 1.11 g/cm3; (11)Flash Point: 217.8 °C; (12)Enthalpy of Vaporization: 66.62 kJ/mol; (13)Boiling Point: 436.4 °C at 760 mmHg; (14)Vapour Pressure: 2.07E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC1(C)OB(OC1(C)C)c3cccnc3OCc2ccccc2
(2)InChI: InChI=1S/C18H22BNO3/c1-17(2)18(3,4)23-19(22-17)15-11-8-12-20-16(15)21-13-14-9-6-5-7-10-14/h5-12H,13H2,1-4H3
(3)InChIKey: IFMSDMPTVPMGOP-UHFFFAOYSA-N