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286961-15-7

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Basic Information
CAS No.: 286961-15-7
Name: 4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-3,6-DIHYDRO-2H-PYRIDINE-1-CARBOXYLIC ACID BENZYL ESTER
Molecular Structure:
Molecular Structure of 286961-15-7 (4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-3,6-DIHYDRO-2H-PYRIDINE-1-CARBOXYLIC ACID BENZYL ESTER)
Formula: C19H26BNO4
Molecular Weight: 343.231
Synonyms: 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylicacid benzyl ester;Benzyl3,6-dihydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-pyridine-1-carboxylate;N-Cbz-3,6-Dihydro-2H-pyridine-4-boronic acid pinacol ester;
Density: 1.13 g/cm3
Melting Point: 88-90℃
Boiling Point: 418.2 °C at 760 mmHg
Flash Point: 206.7 °C
Hazard Symbols: Xi
Risk Codes: 36/37/38
Safety: 26-37
PSA: 48.00000
LogP: 3.52460
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Specification

The N-Cbz-3,6-Dihydro-2H-pyridine-4-boronic acid pinacol ester with the cas number 286961-15-7 is also called 1(2H)-Pyridinecarboxylicacid, 3,6-dihydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-,phenylmethyl ester. The systematic name is benzyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydropyridine-1(2H)-carboxylate. Its molecular formula is C19H26BNO4.

The properties of the chemical are: (1)#H bond acceptors: 5; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 48 Å2; (5)Index of Refraction: 1.541; (6)Molar Refractivity: 95.25 cm3; (7)Molar Volume: 303 cm3; (8)Polarizability: 37.76×10-24cm3; (9)Surface Tension: 41.3 dyne/cm; (10)Enthalpy of Vaporization: 67.17 kJ/mol; (11)Vapour Pressure: 3.35×10-7 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N3CCC(\B2OC(C)(C)C(O2)(C)C)=C/C3
(2)InChI: InChI=1/C19H26BNO4/c1-18(2)19(3,4)25-20(24-18)16-10-12-21(13-11-16)17(22)23-14-15-8-6-5-7-9-15/h5-10H,11-14H2,1-4H3
(3)InChIKey: QDSFHRPYZPQWEJ-UHFFFAOYAF