L-Serine,N-(1-oxotetradecyl)- (21394-57-0)

The N-Myristoyl-L-serine, with the CAS registry number 21394-57-0 and EINECS registry number 244-363-5, has the systematic name of N-tetradecanoyl-L-serine. And the molecular formula of the chemical is C₁₇H₃₃NO₄.

The characteristics of this chemical are as followings: (1)ACD/LogP: 3.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 4; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 86.63 Å²; (13)Index of Refraction: 1.481; (14)Molar Refractivity: 87.49 cm³; (15)Molar Volume: 307.594 cm³; (16)Polarizability: 34.684×10^-24cm³; (17)Surface Tension: 40.806 dyne/cm; (18)Density: 1.026 g/cm³; (19)Flash Point: 268.162 °C; (20)Enthalpy of Vaporization: 91.214 kJ/mol; (21)Boiling Point: 519.793 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)CCCCCCCCCCCCC)CO
(2)InChI: InChI=1/C17H33NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(20)18-15(14-19)17(21)22/h15,19H,2-14H2,1H3,(H,18,20)(H,21,22)/t15-/m0/s1
(3)InChIKey: PNOPPKWUFKUHSX-HNNXBMFYBL