L-Ornithine,N5-[[(2-chlorophenyl)methoxy]carbonyl]- (118553-99-4)

The L-Ornithine,N5-[[(2-chlorophenyl)methoxy]carbonyl]-, with the CAS registry number 118553-99-4, is also known as H-Orn(2-Cl-Z)-OH and N'-(2-Chlorobenzyloxycarbonyl)-L-ornithine. It belongs to the product categories of Amino Acid Derivatives; Amino Acids; Amino Acids and Derivatives; Amino Acids and Derivatives. This chemical's molecular formula is C₁₃H₁₇ClN₂O₄ and molecular weight is 300.74. What's more, its systematic name is called (2S)-2-Amino-5-[(2-chlorophenyl)methoxycarbonylamino]pentanoic acid.

Physical properties about L-Ornithine,N5-[[(2-chlorophenyl)methoxy]carbonyl]- are: (1) ACD/LogP: 2.03; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 6; (4) #H bond donors: 4; (5) #Freely Rotating Bonds: 9; (6) Polar Surface Area: 101.65 Å²; (7) Index of Refraction: 1.566; (8) Molar Refractivity: 74.28 cm³; (9) Molar Volume: 227.7 cm³; (10) Surface Tension: 54.8 dyne/cm; (11) Density: 1.32 g/cm³; (12) Flash Point: 266.3 °C; (13) Enthalpy of Vaporization: 83.06 kJ/mol; (14) Boiling Point: 516.7 °C at 760 mmHg; (15) Vapour Pressure: 1.67E-11 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccccc1COC(=O)NCCC[C@H](N)C(O)=O
(2) InChI: InChI=1/C13H17ClN2O4/c14-10-5-2-1-4-9(10)8-20-13(19)16-7-3-6-11(15)12(17)18/h1-2,4-5,11H,3,6-8,15H2,(H,16,19)(H,17,18)/t11-/m0/s1
(3) InChIKey: TWPRGWUUQAAZHW-NSHDSACABO