Chemical Properties of 17«alpha»-Methyl-17«beta»-hydroxy-1,4-androstadien-3-one, trimethylsilyl deriv. (CAS 41235-52-3)

InChI

InChI=1S/C23H36O2Si/c1-21-12-9-17(24)15-16(21)7-8-18-19(21)10-13-22(2)20(18)11-14-23(22,3)25-26(4,5)6/h9,12,15,18-20H,7-8,10-11,13-14H2,1-6H3

InChI Key

GVUXJYDHSUSHTG-UHFFFAOYSA-N

Formula

C23H36O2Si

SMILES

CC12C=CC(=O)C=C1CCC1C2CCC2(C)C1CCC2(C)O[Si](C)(C)C

Molecular Weight¹

372.62

CAS

41235-52-3

Other Names

• 17«alpha»-Methyl-17«beta»-hydroxy-1,4-androstadien-3-one mono-TMS
• 17-Methyl-17-[(trimethylsilyl)oxy]androsta-1,4-dien-3-one, (17«beta»)-
• Methandienone, 17-TMS
• Methandienone, TMS
• Dianabol trimethylsilyl ether
• Methandrostenolone, tms derivative

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5146		Relay (... Calculated Property
ΔfG°	60.97	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-501.26	kJ/mol	Relay (... Calculated Property
ΔvapH°	109.51	kJ/mol	Relay (... Calculated Property
IE	8.78	eV	Relay (... Calculated Property
log10WS	-5.10		Relay (... Calculated Property
logPoct/wat	5.905		Crippen Calculated Property
Pc	828.75	kPa	Relay (... Calculated Property ⚠️
Inp	[2732.00; 2828.00]
Inp	2732.00		NIST
Inp	2828.00		NIST
Tboil	654.17	K	Relay (... Calculated Property
Tc	912.08	K	Relay (... Calculated Property
Tfus	413.46	K	Relay (... Calculated Property
Vc	1.149	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 17«alpha»-Methyl-17«beta»-hydroxy-1,4-androstadien-3-one, trimethylsilyl deriv..

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• NIST Webbook

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