15-Hydroxypentadecanoic acid

This chemical is called Pentadecanoic acid, 15-hydroxy-, and its systematic name is 15-Hydroxypentadecanoic acid. With the CAS registry number of 4617-33-8, its product categories are Omega-Functional Alkanols, Carboxylic Acids, Amines & Halides; Omega-Hydroxycarboxylic Acids; C13 to C42+Fatty Acids; Carbonyl Compounds; Carboxylic Acids; Hydroxy fatty acids; Saturated fatty acids and Derivatives.  In addition, this chemical should be sealed in the cool and dry plcace where the temperature is 2-8°C. When you are using this chemical, please avoid contacting with skin and eyes.

Other characteristics of the Pentadecanoic acid, 15-hydroxy- can be summarised as followings: (1)ACD/LogP: 4.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.82; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 303.66; (6)ACD/BCF (pH 7.4): 4.87; (7)ACD/KOC (pH 5.5): 1236.58; (8)ACD/KOC (pH 7.4): 19.84; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 15; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.468; (14)Molar Refractivity: 74.64 cm³; (15)Molar Volume: 268.2 cm³; (16)Polarizability: 29.59×10^-24cm³; (17)Surface Tension: 38.3 dyne/cm; (18)Density: 0.963 g/cm³; (19)Flash Point: 210.4 °C; (20)Enthalpy of Vaporization: 75.34 kJ/mol; (21)Boiling Point: 400.9 °C at 760 mmHg; (22)Vapour Pressure: 4.3E-08 mmHg at 25°C.

Production method of this chemical: The Pentadecanoic acid, 15-hydroxy- could be obtained by the reactant of oxacyclohexadecan-2-one. This reaction needs the reagent of KOH, and the solvent of aq. ethanol. The yield is 98.0 %. In addition, this reaction should be taken for 2 hours. The other condition is heating.

Uses of this chemical: The oxacyclohexadecan-2-one could be obtained by the reactant of Pentadecanoic acid, 15-hydroxy-. This reaction needs the catalyst of dealuminated HY zeolite, and the solvent of  m-xylene. The yield is 51 %. This reaction should be taken for 24 hours. The other condition is heating.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)CCCCCCCCCCCCCCO
2.InChI: InChI=1/C15H30O3/c16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15(17)18/h16H,1-14H2,(H,17,18)
3.InChIKey: BZUNJUAMQZRJIP-UHFFFAOYAX