| Identification | |
| Name: | 1-Piperidinecarboxylicacid, 4-(4-aminophenyl)-, 1,1-dimethylethyl ester |
| Synonyms: | 4-(4-Aminophenyl)piperidine-1-carboxylicacid tert-butyl ester;tert-Butyl 4-(4-aminophenyl)-1-piperidinecarboxylate; |
| CAS: | 170011-57-1 |
| Molecular Formula: | C16H24N2O2 |
| Molecular Weight: | 276.37 |
| InChI: | InChI=1/C16H24N2O2/c1-16(2,3)20-15(19)18-10-8-13(9-11-18)12-4-6-14(17)7-5-12/h4-7,13H,8-11,17H2,1-3H3 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.1 g/cm3 |
| Refractive index: | 1.551 |
| Specification: |
The 4-(4-Aminophenyl)piperidine-1-carboxylic acid tert-butyl ester, with the cas registry number 170011-57-1, has the systematic name of tert-butyl 4-(4-aminophenyl)piperidine-1-carboxylate. And the molecular formula of the chemical is C16H24N2O2. The characteristics of this chemical are as followings: (1)ACD/LogP: 2.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 26; (6)ACD/BCF (pH 7.4): 34; (7)ACD/KOC (pH 5.5): 326; (8)ACD/KOC (pH 7.4): 433; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.56 Å2; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 80.12 cm3; (15)Molar Volume: 251.162 cm3; (16)Polarizability: 31.762×10-24cm3; (17)Surface Tension: 44.54 dyne/cm; (18)Density: 1.1 g/cm3; (19)Flash Point: 203.417 °C; (20)Enthalpy of Vaporization: 66.541 kJ/mol; (21)Boiling Point: 412.737 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C. Addtionally, the following datas could be converted into the molecular structure: |
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