Chemical Properties of Androstan-16-one, (5«alpha»)- (CAS 1032-16-2)

InChI

InChI=1S/C19H30O/c1-18-10-8-16-15(17(18)11-14(20)12-18)7-6-13-5-3-4-9-19(13,16)2/h13,15-17H,3-12H2,1-2H3/t13-,15-,16+,17+,18-,19+/m0/s1

InChI Key

UYNXNPZDSGEDON-QKAVBZAFSA-N

Formula

C19H30O

SMILES

CC12CCC3C(CCC4CCCCC43C)C1CC(=O)C2

Molecular Weight¹

274.44

CAS

1032-16-2

Other Names

• 5«alpha»-Androstan-16-one
• Androstan-16-one

• 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
ΔfG°	142.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-322.99	kJ/mol	Joback Calculated Property
ΔfusH°	16.06	kJ/mol	Joback Calculated Property
ΔvapH°	59.73	kJ/mol	Joback Calculated Property
log10WS	-5.18		Crippen Calculated Property
logPoct/wat	4.988		Crippen Calculated Property
McVol	236.700	ml/mol	McGowan Calculated Property
Pc	1829.41	kPa	Joback Calculated Property
Inp	[1930.00; 1942.00]
Inp	1930.00		NIST
Inp	1942.00		NIST
Inp	1930.00		NIST
Tboil	741.39	K	Joback Calculated Property
Tc	995.68	K	Joback Calculated Property
Tfus	465.59	K	Joback Calculated Property
Vc	0.888	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[789.31; 951.68]	J/mol×K	[741.39; 995.68]
Cp,gas	789.31	J/mol×K	741.39	Joback Calculated Property
Cp,gas	817.52	J/mol×K	783.77	Joback Calculated Property
Cp,gas	844.73	J/mol×K	826.15	Joback Calculated Property
Cp,gas	871.34	J/mol×K	868.54	Joback Calculated Property
Cp,gas	897.76	J/mol×K	910.92	Joback Calculated Property
Cp,gas	924.41	J/mol×K	953.30	Joback Calculated Property
Cp,gas	951.68	J/mol×K	995.68	Joback Calculated Property

Similar Compounds

Find more compounds similar to Androstan-16-one, (5«alpha»)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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