CAS No.41736-92-9,N-Hexadecanoyl-4-hydroxy-L-proline Suppliers

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Basic Information

Molecular Structure:
CAS No.:	41736-92-9
Name:	N-Hexadecanoyl-4-hydroxy-L-proline
Article Data:	2

Formula:	C₂₁H₃₉NO₄
Molecular Weight:	369.545
Synonyms:	L-Proline,4-hydroxy-1-(1-oxohexadecyl)-, trans-;N-Palmitoylhydroxyproline;N-Hexadecanoyl-4-hydroxy-L-proline;
Density:	1.051 g/cm³
Boiling Point:	548.1 °C at 760 mmHg
Flash Point:	285.3 °C
PSA:	66.84000
LogP:	5.32900

Total:19 Page 1 of 1 1

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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