tert-Butyl methyl(piperidin-4-ylmethyl)carbamate (138022-04-5)

The tert-Butyl methyl(piperidin-4-ylmethyl)carbamate with the cas number 138022-04-5 is also called carbamic acid, N-methyl-N-(4-piperidinylmethyl)-, 1,1-dimethylethyl ester. Its molecular formula is C₁₂H₂₄N₂O₂. This chemical is irritant. While using this chemical, you should be very cautious.

The properties of the chemical are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 41.57 Å²; (11)Index of Refraction: 1.464; (12)Molar Refractivity: 64.36 cm³; (13)Molar Volume: 233.376 cm³; (14)Polarizability: 25.514×10^-24cm³; (15)Surface Tension: 33.529 dyne/cm; (16)Enthalpy of Vaporization: 54.65 kJ/mol; (17)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)N(C)CC1CCNCC1
(2)InChI: InChI=1/C12H24N2O2/c1-12(2,3)16-11(15)14(4)9-10-5-7-13-8-6-10/h10,13H,5-9H2,1-4H3
(3)InChIKey: ZREUHPKGCXOWCK-UHFFFAOYAY