The CAS register number of Carbamic acid, methyl(3S)-3-piperidinyl-, 1,1-dimethylethylester is 309962-63-8. It also can be called as (S)-3-(N-Boc-methylamino)piperidine and the systematic name about this chemical is tert-butyl 2-[[(3S)-3-piperidyl]amino]acetate. The molecular formula about this chemical is C11H22N2O2 and the molecular weight is 214.3046.
Physical properties about Carbamic acid, methyl(3S)-3-piperidinyl-, 1,1-dimethylethylester are: (1)ACD/LogP: 1.73; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 50.36Å2; (10)Index of Refraction: 1.48; (11)Molar Refractivity: 60.077 cm3; (12)Molar Volume: 211.573 cm3; (13)Polarizability: 23.816x10-24cm3; (14)Surface Tension: 35.741 dyne/cm; (15)Enthalpy of Vaporization: 53.999 kJ/mol; (16)Boiling Point: 299.961 °C at 760 mmHg; (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)CN[C@H]1CCCNC1
(2)InChI: InChI=1/C11H22N2O2/c1-11(2,3)15-10(14)8-13-9-5-4-6-12-7-9/h9,12-13H,4-8H2,1-3H3/t9-/m0/s1
(3)InChIKey: RXQNXRZGNVKFNW-VIFPVBQEBX
(4)Std. InChI: InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)8-13-9-5-4-6-12-7-9/h9,12-13H,4-8H2,1-3H3/t9-/m0/s1
(5)Std. InChIKey: RXQNXRZGNVKFNW-VIFPVBQESA-N
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