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D-Lysine,N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]- (110990-07-3)

Identification
Name:D-Lysine,N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]-
Synonyms:N~6~-[(benzyloxy)carbonyl]-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-lysine;D-lysine, N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-N~6~-[(phenylmethoxy)carbonyl]-;N~6~-[(Benzyloxy)carbonyl]-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-lysine;D-Lysine, N2-[9H-fluoren-9-ylmethoxy)carbonyl]-amino]hexanoic acid;
CAS:110990-07-3
Molecular Formula: C29H30N2O6
Molecular Weight: 502.56
InChI: InChI=1/C29H30N2O6/c32-27(33)26(16-8-9-17-30-28(34)36-18-20-10-2-1-3-11-20)31-29(35)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-7,10-15,25-26H,8-9,16-19H2,(H,30,34)(H,31,35)(H,32,33)/t26-/m1/s1
Molecular Structure: (C29H30N2O6) N~6~-[(benzyloxy)carbonyl]-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-lysine;D-lysine, N~2~-[(9H-fluo...
Properties
Density:1.261 g/cm3
Refractive index:1.603
Specification:

The N-Fmoc-N'-Cbz-D-lysine, with the cas registry number 110990-07-3, has the systematic name of N~6~-[(benzyloxy)carbonyl]-N~2~-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-lysine. It belongs to the product categories of Amino Acid Derivatives and Amino Acids. The molecular formula of the chemical is C29H30N2O6.

The characteristics of this chemical are as followings: (1)ACD/LogP: 5.58; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 3.57; (4)ACD/LogD (pH 7.4): 2.06 ; (5)#H bond acceptors: 8; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 13; (8)Polar Surface Area: 113.96 Å2; (9)Index of Refraction: 1.603; (10)Molar Refractivity: 136.93 cm3; (11)Molar Volume: 398.2 cm3; (12)Polarizability: 54.28×10-24cm3; (13)Surface Tension: 55.2 dyne/cm; (14)Density: 1.261 g/cm3; (15)Flash Point: 408.1 °C; (16)Enthalpy of Vaporization: 114.89 kJ/mol; (17)Boiling Point: 751.2 °C at 760 mmHg; (18)Vapour Pressure: 1.04E-23 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1ccc(cc1)COC(=O)NCCCCC(C(=O)O)NC(=O)OCC2c3ccccc3-c4c2cccc4
(2)InChI: InChI=1/C29H30N2O6/c32-27(33)26(16-8-9-17-30-28(34)36-18-20-10-2-1-3-11-20)31-29(35)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-7,10-15,25-26H,8-9,16-19H2,(H,30,34)(H,31,35)(H,32,33)/t26-/m1/s1
(3)InChIKey: KRULQRVJXQQPQH-AREMUKBSBK

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