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CAS No.: | 220394-97-8 |
---|---|
Name: | 1-BOC-4-CBZ-AMINO-PIPERIDINE |
Article Data: | 18 |
Molecular Structure: | |
Formula: | C18H26N2O4 |
Molecular Weight: | 334.415 |
Synonyms: | 4-Benzyloxycarbonylaminopiperidine-1-carboxylicacid tert-butyl ester; |
Density: | 1.156 g/cm3 |
Melting Point: | 88 °C |
Boiling Point: | 471.582 °C at 760 mmHg |
Flash Point: | 239.004 °C |
Safety: | 24/25 |
PSA: | 67.87000 |
LogP: | 3.64110 |
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The 4-Benzyloxycarbonylamino-N-Boc-piperdine, also known as 1-Boc-4-Cbz-amino-piperidine, is an organic compound with the formula C18H26N2O4. With the CAS registry number 220394-97-8, its systematic name is tert-butyl 4-{[(benzyloxy)carbonyl]amino}piperidine-1-carboxylate.
Physical properties of 4-Benzyloxycarbonylamino-N-Boc-piperdine: (1)ACD/LogP: 3.06; (2)ACD/LogD (pH 5.5): 3.06; (3)ACD/LogD (pH 7.4): 3.06; (4)ACD/BCF (pH 5.5): 124.14; (5)ACD/BCF (pH 7.4): 124.14; (6)ACD/KOC (pH 5.5): 1097.55; (7)ACD/KOC (pH 7.4): 1097.53; (8)#H bond acceptors: 6; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Index of Refraction: 1.545; (12)Molar Refractivity: 91.5 cm3; (13)Molar Volume: 289.2 cm3; (14)Surface Tension: 46.4 dyne/cm; (15)Density: 1.15 g/cm3; (16)Flash Point: 239 °C; (17)Enthalpy of Vaporization: 73.44 kJ/mol; (18)Boiling Point: 471.6 °C at 760 mmHg; (19)Vapour Pressure: 4.6E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
SMILES: O=C(OC(C)(C)C)N2CCC(NC(=O)OCc1ccccc1)CC2
InChI: InChI=1/C18H26N2O4/c1-18(2,3)24-17(22)20-11-9-15(10-12-20)19-16(21)23-13-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,19,21)
InChIKey: GKBFRLAMTVIDHL-UHFFFAOYAG