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865245-32-5

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Basic Information
CAS No.: 865245-32-5
Name: tert-butyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydropyridine-1(2H)-carboxylate
Article Data: 2
Molecular Structure:
Molecular Structure of 865245-32-5 (tert-butyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydropyridine-1(2H)-carboxylate)
Formula: C16H28BNO4
Molecular Weight: 309.214
Synonyms: N-Boc-3,4-Dihydropyridine-6-boronic acid pinacol ester;
Density: 1.055 g/cm3
Boiling Point: 355.192 °C at 760 mmHg
Flash Point: 168.614 °C
PSA: 48.00000
LogP: 3.47050
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Specification

The N-Boc-3,4-Dihydropyridine-6-boronic acid pinacol ester with its cas register number is 865245-32-5. It also can be called as 3,4-Dihydro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1(2H)-pyridinecarboxylic acid tert butyl ester and the Systematic name about this chemical is tert-butyl 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydropyridine-1(2H)-carboxylate.

Physical properties about N-Boc-3,4-Dihydropyridine-6-boronic acid pinacol ester are: (1)#H bond acceptors: 5; (2)#Freely Rotating Bonds: 3; (3)Polar Surface Area: 48Å2; (4)Index of Refraction: 1.488; (5)Molar Refractivity: 84.439 cm3; (6)Molar Volume: 292.996 cm3; (7)Polarizability: 33.474x10-24cm3; (8)Surface Tension: 34.724 dyne/cm; (9)Enthalpy of Vaporization: 60.031 kJ/mol.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N2C(\B1OC(C)(C)C(O1)(C)C)=C/CCC2
(2)InChI: InChI=1/C16H28BNO4/c1-14(2,3)20-13(19)18-11-9-8-10-12(18)17-21-15(4,5)16(6,7)22-17/h10H,8-9,11H2,1-7H3
(3)InChIKey: LEQQJEMLERIVAW-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C16H28BNO4/c1-14(2,3)20-13(19)18-11-9-8-10-12(18)17-21-15(4,5)16(6,7)22-17/h10H,8-9,11H2,1-7H3
(5)Std. InChIKey: LEQQJEMLERIVAW-UHFFFAOYSA-N