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5-alpha-Dihydrotestosterone propionate Chemical Properties
Molecule structure of 5-alpha-Dihydrotestosterone propionate (CAS NO.855-22-1) :
IUPAC Name: [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] propanoate
Molecular Weight: 346.50356 g/mol
Molecular Formula: C22H34O3
Density: 1.08 g/cm3
Boiling Point: 438 °C at 760 mmHg
Flash Point: 188 °C
Molar Volume: 318.6 cm3
Polarizability: 38.*10-24 cm3
Surface Tension: 41 dyne/cm
Enthalpy of Vaporization: 69.48 kJ/mol
Vapour Pressure: 7.13E-08 mmHg at 25 °C
XLogP3: 4.7
H-Bond Acceptor: 3
Rotatable Bond Count: 3
Tautomer Count: 3
Exact Mass: 346.250795
MonoIsotopic Mass: 346.250795
Topological Polar Surface Area: 43.4
Heavy Atom Count: 25
Complexity: 570
Defined Atom StereoCenter Count: 7
Canonical SMILES: CCC(=O)OC1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C
Isomeric SMILES: CCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C
InChI: InChI=1S/C22H34O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h14,16-19H,4-13H2,1-3H3/t14-,16-,17-,18-,19-,21-,22-/m0/s1
InChIKey: XTAARPJDFFXHGH-GRPBBMKTSA-N
EINECS: 212-722-5
Product Categories: Steroids |
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