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L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, (4R)- (41736-92-9)

Identification
Name:L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, (4R)-
Synonyms:L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, trans-;N-Palmitoylhydroxyproline;N-Hexadecanoyl-4-hydroxy-L-proline;
CAS:41736-92-9
Molecular Formula: C21H39NO4
Molecular Weight: 369.54
InChI: InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)22-17-18(23)16-19(22)21(25)26/h18-19,23H,2-17H2,1H3,(H,25,26)/t18?,19-/m0/s1
Molecular Structure: (C21H39NO4) L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, trans-;N-Palmitoylhydroxyproline;N-Hexadecanoyl-4-hydroxy-L...
Properties
Density:1.051
Refractive index:1.502
Specification:

The N-Hexadecanoyl-4-hydroxy-L-proline with the CAS number 41736-92-9 is also called L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, (4R)-. The systematic name is L-proline, 4-hydroxy-1-(1-oxohexadecyl)-. Its molecular formula is C21H39NO4. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 5.40; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.46; (4)ACD/LogD (pH 7.4): 1.91; (5)ACD/BCF (pH 5.5): 86.54; (6)ACD/BCF (pH 7.4): 2.41; (7)ACD/KOC (pH 5.5): 238.82; (8)ACD/KOC (pH 7.4): 6.66; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 77.84 Å2; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 103.77 cm3; (15)Molar Volume: 351.3 cm3; (16)Polarizability: 41.14×10-24cm3; (17)Surface Tension: 44.6 dyne/cm; (18)Enthalpy of Vaporization: 95.13 kJ/mol; (19)Vapour Pressure: 2.7×10-14 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCCCCCCCCCCC(=O)N1CC(C[C@H]1C(=O)O)O
(2)InChI: InChI=1/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)22-17-18(23)16-19(22)21(25)26/h18-19,23H,2-17H2,1H3,(H,25,26)/t18?,19-/m0/s1
(3)InChIKey: SRHSPJGTSWHUTH-GGYWPGCIBX

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