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325486-37-1

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Basic Information
CAS No.: 325486-37-1
Name: N-Benzyl-3-(tert-butyldimethylsilanyloxymethyl)piperid-4-one
Article Data: 2
Molecular Structure:
Molecular Structure of 325486-37-1 (N-Benzyl-3-(tert-butyldimethylsilanyloxymethyl)piperid-4-one)
Formula: C19H31NO2Si
Molecular Weight: 333.546
Synonyms: 1-Benzyl-3-(tert-butyldimethylsilyloxy)methyl-4-oxopiperidine;
Density: 0.997 g/cm3
Boiling Point: 397.685 °C at 760 mmHg
Flash Point: 194.313 °C
Hazard Symbols: CorrosiveC
PSA: 29.54000
LogP: 4.03730
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Specification

The 4-Piperidinone,3-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-1-(phenylmethyl)-, with the CAS registry number 325486-37-1, is also known as N-Benzyl 3-(tert-butyl-dimethyl-silanyloxymethyl)-piperidin-4-one. This chemical's molecular formula is C19H31NO2Si and molecular weight is 333.54044. Its systematic name is called 1-benzyl-3-({[tert-butyl(dimethyl)silyl]oxy}methyl)piperidin-4-one. When you are using this chemical, please be cautious about it. This chemical may destroy living tissue on contact.

Physical properties of 4-Piperidinone,3-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-1-(phenylmethyl)-: (1)ACD/LogP: 4.49; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 46; (5)ACD/BCF (pH 7.4): 565; (6)ACD/KOC (pH 5.5): 254; (7)ACD/KOC (pH 7.4): 3105; (8)#H bond acceptors: 3; (9)#H bond donors: 0; (10)#Freely Rotating Bonds: 6; (11)Index of Refraction: 1.503; (12)Molar Refractivity: 98.841 cm3; (13)Molar Volume: 334.568 cm3; (14)Surface Tension: 32.882 dyne/cm; (15)Density: 0.997 g/cm3; (16)Flash Point: 194.313 °C; (17)Enthalpy of Vaporization: 64.816 kJ/mol; (18)Boiling Point: 397.685 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)[Si](C)(C)OCC2CN(Cc1ccccc1)CCC2=O
(2)InChI: InChI=1/C19H31NO2Si/c1-19(2,3)23(4,5)22-15-17-14-20(12-11-18(17)21)13-16-9-7-6-8-10-16/h6-10,17H,11-15H2,1-5H3
(3)InChIKey: WOYQEVXRQBRUAL-UHFFFAOYAR