CLOCORTOLONE PIVALATE (200 MG)

The Clocortolone pivalate, with the CAS registry number 34097-16-0, is also known as 9α-Chloro-6α-fluoro-11β,21-dihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-pivalate. It belongs to the product categories of Intermediates & Fine Chemicals; Pharmaceuticals; Steroids. Its EINECS number is 251-826-5. This chemical's molecular formula is C₂₇H₃₆ClFO₅ and molecular weight is 495.02. What's more, its systematic name is (6α,11β,16α)-9-Chloro-6-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl pivalate. Its classification codes are: (1)Adrenal Cortex Hormones; (2)Glucocorticoid; (3)Glucocorticoids; (4)Hormones; (5)Hormones, Hormone Substitutes, and Hormone Antagonists. This chemical is a topical, anti-inflammatory glucocorticoid. It is used in the form of an ester, clocortolone pivalate, and applied as a cream.

Physical properties of Clocortolone pivalate are: (1)ACD/LogP: 3.757; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.76; (4)ACD/LogD (pH 7.4): 3.76; (5)ACD/BCF (pH 5.5): 422.27; (6)ACD/BCF (pH 7.4): 422.27; (7)ACD/KOC (pH 5.5): 2636.33; (8)ACD/KOC (pH 7.4): 2636.32; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 80.67 Å²; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 126.965 cm³; (15)Molar Volume: 397.564 cm³; (16)Polarizability: 50.333×10^-24cm³; (17)Surface Tension: 46.66 dyne/cm; (18)Density: 1.245 g/cm³; (19)Flash Point: 315.447 °C; (20)Enthalpy of Vaporization: 102.187 kJ/mol; (21)Boiling Point: 597.979 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(=O)[C@@H]3[C@]2(C[C@H](O)[C@]4(Cl)[C@@]/1(\C(=C/C(=O)\C=C\1)[C@@H](F)C[C@H]4[C@@H]2C[C@H]3C)C)C)C(C)(C)C
(2)Std. InChI: InChI=1S/C27H36ClFO5/c1-14-9-16-17-11-19(29)18-10-15(30)7-8-26(18,6)27(17,28)21(32)12-25(16,5)22(14)20(31)13-34-23(33)24(2,3)4/h7-8,10,14,16-17,19,21-22,32H,9,11-13H2,1-6H3/t14-,16+,17+,19+,21+,22-,25+,26+,27+/m1/s1
(3)Std. InChIKey: SXYZQZLHAIHKKY-GSTUPEFVSA-N