CAS No.564-32-9,11-hydroxyandrost-4-ene-3,17-dione Suppliers

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Basic Information

Molecular Structure:
CAS No.:	564-32-9
Name:	11-hydroxyandrost-4-ene-3,17-dione
Article Data:	15

Formula:	C₁₉H₂₆O₃
Molecular Weight:	302.414
Synonyms:	11-Hydroxy-4-androstene-3,17-dione;D4-Androstene-11-ol-3,17-dione;
Density:	1.19g/cm³
Boiling Point:	475.3 °C at 760 mmHg
Flash Point:	255.4 °C

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Specification

The Androst-4-ene-3,17-dione,11-hydroxy-, with CAS registry number 564-32-9, has the systematic name of 11-hydroxyandrost-4-ene-3,17-dione. Besides this, it is also called 11-Hydroxyandrostenedione. Its molecular weight is 302.4079. And the chemical formula of this chemical is C₁₉H₂₆O₃.

Physical properties of Androst-4-ene-3,17-dione,11-hydroxy-: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.27; (4)ACD/LogD (pH 7.4): 1.27; (5)ACD/BCF (pH 5.5): 5.47; (6)ACD/BCF (pH 7.4): 5.47; (7)ACD/KOC (pH 5.5): 117.4; (8)ACD/KOC (pH 7.4): 117.4; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 43.37 Å²; (13)Index of Refraction: 1.569; (14)Molar Refractivity: 83.22 cm³; (15)Molar Volume: 253.8 cm³; (16)Polarizability: 32.99×10^-24cm³; (17)Surface Tension: 48.1 dyne/cm; (18)Density: 1.19 g/cm³; (19)Flash Point: 255.4 °C; (20)Enthalpy of Vaporization: 85.16 kJ/mol; (21)Boiling Point: 475.3 °C at 760 mmHg; (22)Vapour Pressure: 4.95E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C4/C=C3/CC[C@H]2[C@H]1[C@@](C(=O)CC1)(CC(O)[C@@H]2[C@@]3(C)CC4)C
(2)InChI: InChI=1/C19H26O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14-,15?,17+,18-,19-/m0/s1
(3)InChIKey: WSCUHXPGYUMQEX-CRIVMUBDBC
(4)Std. InChI: InChI=1S/C19H26O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14-,15?,17+,18-,19-/m0/s1
(5)Std. InChIKey: WSCUHXPGYUMQEX-CRIVMUBDSA-N