Chemical Properties of Androsterone (CAS 53-41-8)

InChI

InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14?,15?,16?,18?,19?/m1/s1

InChI Key

QGXBDMJGAMFCBF-WRBSTAHLSA-N

Formula

C19H30O2

SMILES

CC12CCC3C(CCC4CC(O)CCC43C)C1CCC2=O

Molecular Weight¹

290.44

CAS

53-41-8

Other Names

• 3-Epihydroxyetioallocholan-17-one
• 3-«alpha»-Hydroxy-5-«alpha»-androstan-17-one
• 3-«alpha»-Hydroxy-5-«alpha»-androstan-17-one
• 3«alpha»-Hydroxy-17-androstanone
• 3«alpha»-Hydroxyetioallocholan-17-one
• 3«alpha»-Hydroxy-17-androstanone
• 3«alpha»-Hydroxyetioallocholan-17-one
• 5-«alpha»-Androstan-3-«alpha»-ol-17-one
• 5-«alpha»-Androstan-3-«alpha»-ol-17-one
• 5«alpha»-Androstan-17-one, 3«alpha»-hydroxy-
• 5«alpha»-Androstane-3«alpha»-ol-17-one
• 5«alpha»-Androsterone
• 5«alpha»-Androstan-17-one, 3«alpha»-hydroxy-
• 5«alpha»-Androstane-3«alpha»-ol-17-one
• 5«alpha»-Androsterone
• Androkinine
• Androstan-17-one, 3-hydroxy-, (3«alpha»,5«alpha»)-
• Androstan-17-one, 3-hydroxy-, (3«alpha»,5«alpha»)-
• Androstanon-3-«alpha»-ol-17-one
• Androstanon-3-«alpha»-ol-17-one
• Androtine
• Atromide ICI
• NSC 9898
• U 6036
• cis-Androsterone

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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
ΔcH°solid	-11090.00 ± 30.00	kJ/mol	NIST
ΔfG°	-1.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-495.56	kJ/mol	Joback Calculated Property
ΔfusH°	21.22	kJ/mol	Joback Calculated Property
ΔvapH°	76.10	kJ/mol	Joback Calculated Property
log10WS	[-4.40; -4.16]
log10WS	-4.16		Aq. Sol...
log10WS	-4.40		Estimat...
logPoct/wat	3.959		Crippen Calculated Property
McVol	242.570	ml/mol	McGowan Calculated Property
Pc	1925.36	kPa	Joback Calculated Property
Inp	[2480.00; 2498.00]
Inp	Outlier 2498.00		NIST
Inp	2480.00		NIST
Inp	2484.00		NIST
Inp	2486.00		NIST
Inp	2488.00		NIST
Inp	2488.00		NIST
Inp	2480.00		NIST
Inp	2484.00		NIST
Tboil	828.90	K	Joback Calculated Property
Tc	1062.98	K	Joback Calculated Property
Tfus	522.17	K	Joback Calculated Property
Vc	0.906	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[870.61; 1022.62]	J/mol×K	[828.90; 1062.98]
Cp,gas	870.61	J/mol×K	828.90	Joback Calculated Property
Cp,gas	895.49	J/mol×K	867.91	Joback Calculated Property
Cp,gas	920.14	J/mol×K	906.93	Joback Calculated Property
Cp,gas	944.87	J/mol×K	945.94	Joback Calculated Property
Cp,gas	969.98	J/mol×K	984.95	Joback Calculated Property
Cp,gas	995.80	J/mol×K	1023.97	Joback Calculated Property
Cp,gas	1022.62	J/mol×K	1062.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to Androsterone.

Sources

• Crippen Method
• Joback Method
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.