Specification: |
The 1-N-Boc-cis-1,4-cyclohexyldiamine, its cas register number is 247570-24-7. It also can be called as Carbamic acid,N-(cis-4-aminocyclohexyl)-, 1,1-dimethylethyl ester and the IUPAC name about this chemical is tert-butyl N-(4-aminocyclohexyl)carbamate. It belongs to the N-BOC.
Physical properties about 1-N-Boc-cis-1,4-cyclohexyldiamine are: (1)#H bond acceptors: 4; (2)#H bond donors: 3; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 64.35Å2; (5)Index of Refraction: 1.488; (6)Molar Refractivity: 60.02 cm3; (7)Molar Volume: 208.2 cm3; (8)Polarizability: 23.79x10-24cm3; (9)Surface Tension: 37.9 dyne/cm; (10) Enthalpy of Vaporization: 56.39 kJ/mol; (11)Vapour Pressure: 0.000286 mmHg at 25°C
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)NC1CCC(CC1)N
(2)InChI: InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-6-4-8(12)5-7-9/h8-9H,4-7,12H2,1-3H3,(H,13,14)
(3)InChIKey: FEYLUKDSKVSMSZ-UHFFFAOYSA-N
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