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CAS No.: | 877149-81-0 |
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Name: | 3-HYDROXYMETHYL-PYRIDYL-5-BORONIC ACID PINACOL ESTER |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C12H18BNO3 |
Molecular Weight: | 235.09 |
Synonyms: | [5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridin-3-yl]methanol; |
Density: | 1.111 g/cm3 |
Boiling Point: | 388.309 °C at 760 mmHg |
Flash Point: | 188.643 °C |
PSA: | 51.58000 |
LogP: | 0.87310 |
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This chemical is called 3-Pyridinemethanol,5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, and its systematic name is [5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridyl]methanol. With the molecular formula of C12H18BNO3, its molecular weight is 235.09. The CAS registry number of this chemical is 877149-81-0.
Other characteristics of the 3-Pyridinemethanol,5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- can be summarised as followings: (1)#H bond acceptors: 4; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 51.58 Å2; (5)Index of Refraction: 1.511; (6)Molar Refractivity: 63.415 cm3; (7)Molar Volume: 211.543 cm3; (8)Polarizability: 25.14×10-24cm3; (9)Surface Tension: 40.212 dyne/cm; (10)Density: 1.111 g/cm3; (11)Flash Point: 188.643 °C; (12)Enthalpy of Vaporization: 67.239 kJ/mol; (13)Boiling Point: 388.309 °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)c2cc(cnc2)CO
2.InChI: InChI=1/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)10-5-9(8-15)6-14-7-10/h5-7,15H,8H2,1-4H3
3.InChIKey: MMZYOXJIDQOQJT-UHFFFAOYAD