1-(9H-fluoren-9-ylmethoxycarbonyl)-4-(tert-butoxycarbonylamino)piperidine-4-carboxylate (368866-07-3)

The 4-(Boc-amino)-1-Fmoc-piperdine-4-carboxylic acid, with CAS registry number 368866-07-3, belongs to the following product categories: (1)N-BOC; (2)Amino Acids 13C, 2H, 15N; (3)Amino Acids & Derivatives; (4)Heterocycles. It has the systematic name of 4-[(tert-butoxycarbonyl)amino]-1-[(9H-fluoren-9-ylmethoxy)carbonyl]piperidine-4-carboxylic acid.

Physical properties about this chemical are: (1)ACD/LogP: 4.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.6; (4)ACD/LogD (pH 7.4): 1.08; (5)ACD/BCF (pH 5.5): 18.59; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 76.39; (8)ACD/KOC (pH 7.4): 2.3; (9)#H bond acceptors: 8; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 85.38 Å²; (13)Index of Refraction: 1.622; (14)Molar Refractivity: 125.08 cm³; (15)Molar Volume: 354.9 cm³; (16)Polarizability: 49.58×10^-24cm³; (17)Surface Tension: 61.5 dyne/cm; (18)Enthalpy of Vaporization: 101.79 kJ/mol; (19)Vapour Pressure: 3.23E-18 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 4-(Boc-amino)-1-Fmoc-piperdine-4-carboxylic acid irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC3c1ccccc1c2ccccc23)N4CCC(NC(=O)OC(C)(C)C)(C(=O)O)CC4
(2)InChI: InChI=1/C26H30N2O6/c1-25(2,3)34-23(31)27-26(22(29)30)12-14-28(15-13-26)24(32)33-16-21-19-10-6-4-8-17(19)18-9-5-7-11-20(18)21/h4-11,21H,12-16H2,1-3H3,(H,27,31)(H,29,30)
(3)InChIKey: SHJZHFAOEGNFGY-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C26H30N2O6/c1-25(2,3)34-23(31)27-26(22(29)30)12-14-28(15-13-26)24(32)33-16-21-19-10-6-4-8-17(19)18-9-5-7-11-20(18)21/h4-11,21H,12-16H2,1-3H3,(H,27,31)(H,29,30)
(5)Std. InChIKey: SHJZHFAOEGNFGY-UHFFFAOYSA-N