3-Boc-amino-2,6-dioxopiperidine (31140-42-8)

The CAS register number of 3-Boc-amino-2,6-dioxopiperidine is 31140-42-8. It also can be called as 2,6-Dioxo-3-piperidinecarbamic acid tert-butyl ester and the IUPAC name about this chemical is tert-butyl N-(2,6-dioxopiperidin-3-yl)carbamate. The molecular formula about this chemical is C₁₀H₁₆N₂O₄ and the molecular weight is 228.25. It belongs to the Pharmacetical.

Physical properties about 3-Boc-amino-2,6-dioxopiperidine are: (1)ACD/LogP: 0.73; (2)ACD/LogD (pH 5.5): 0.73; (3)ACD/LogD (pH 7.4): 0.73; (4)ACD/BCF (pH 5.5): 2.1; (5)ACD/BCF (pH 7.4): 2.1; (6)ACD/KOC (pH 5.5): 59.16; (7)ACD/KOC (pH 7.4): 59.11; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 66.92Ų; (12)Index of Refraction: 1.499; (13)Molar Refractivity: 55.67 cm³; (14)Molar Volume: 189.3 cm³; (15)Polarizability: 22.07x10^-24cm³; (16)Surface Tension: 44 dyne/cm; (17)Enthalpy of Vaporization: 67.72 kJ/mol; (18)Boiling Point: 423 °C at 760 mmHg; (19)Vapour Pressure: 2.32E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)CCC1NC(=O)OC(C)(C)C
(2)InChI: InChI=1/C10H16N2O4/c1-10(2,3)16-9(15)11-6-4-5-7(13)12-8(6)14/h6H,4-5H2,1-3H3,(H,11,15)(H,12,13,14)
(3)InChIKey: TUGRLMXVKASPTN-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C10H16N2O4/c1-10(2,3)16-9(15)11-6-4-5-7(13)12-8(6)14/h6H,4-5H2,1-3H3,(H,11,15)(H,12,13,14)
(5)Std. InChIKey: TUGRLMXVKASPTN-UHFFFAOYSA-N