1-Piperidinecarboxylicacid, 3-(2-hydroxyethyl)-, 1,1-dimethylethyl ester, (3R)- (389889-62-7)

The (R)-1-N-Boc-3-(2-hydroxyethyl)piperidine, with the CAS registry number 389889-62-7, is also known as 1-Piperidinecarboxylic acid, 3-(2-hydroxyethyl)-, 1,1-dimethylethyl ester, (3R)- and (R)-3-(2-Hydroxyethyl)piperidine-1-carboxylic acid tert-butyl ester. This chemical's molecular formula is C₁₂H₂₃NO₃ and formula weight is 229.32. What's more, its systematic name is called tert-Butyl (3R)-3-(2-hydroxyethyl)piperidine-1-carboxylate.

Physical properties about this chemical are: (1)ACD/LogP: 1.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.25; (4)ACD/LogD (pH 7.4): 1.25; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 49.77 Å²; (9)Index of Refraction: 1.478; (10)Molar Refractivity: 62.3 cm³; (11)Molar Volume: 219.7 cm³; (12)Surface Tension: 37.5 dyne/cm; (13)Density: 1.043 g/cm³; (14)Flash Point: 149.8 °C; (15)Enthalpy of Vaporization: 65.61 kJ/mol; (16)Boiling Point: 324.1 °C at 760 mmHg; (17)Vapour Pressure: 1.97E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N1C[C@H](CCC1)CCO
(2)InChI: InChI=1/C12H23NO3/c1-12(2,3)16-11(15)13-7-4-5-10(9-13)6-8-14/h10,14H,4-9H2,1-3H3/t10-/m1/s1
(3)InChIKey: DXABICKZWDHPIP-SNVBAGLBBT