Chemical Properties of 31-Nor-7-lanosterol acetate

InChI

InChI=1S/C31H52O2/c1-9-10-11-12-21(2)23-15-19-31(8)25-13-14-26-28(4,5)27(33-22(3)32)17-18-29(26,6)24(25)16-20-30(23,31)7/h13,21,23-24,26-27H,9-12,14-20H2,1-8H3/t21-,23?,24?,26?,27-,29+,30+,31-/m1/s1

InChI Key

KAQDYZSKYROZFD-IMQMZZFDSA-N

Formula

C31H52O2

SMILES

CCCCCC(C)C1CCC2(C)C3=CCC4C(C)(C)C(OC(C)=O)CCC4(C)C3CCC12C

Molecular Weight¹

456.74

• 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°	123.81	kJ/mol	Joback Calculated Property
ΔfH°gas	-646.94	kJ/mol	Joback Calculated Property
ΔfusH°	37.27	kJ/mol	Joback Calculated Property
ΔvapH°	88.99	kJ/mol	Joback Calculated Property
log10WS	-9.27		Crippen Calculated Property
logPoct/wat	8.740		Crippen Calculated Property
McVol	407.350	ml/mol	McGowan Calculated Property
Pc	851.97	kPa	Joback Calculated Property
Inp	[3286.00; 3286.00]
Inp	3286.00		NIST
Inp	3286.00		NIST
Tboil	1019.26	K	Joback Calculated Property
Tc	1254.31	K	Joback Calculated Property
Tfus	642.37	K	Joback Calculated Property
Vc	1.552	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1598.35; 1942.16]	J/mol×K	[1019.26; 1254.31]
Cp,gas	1598.35	J/mol×K	1019.26	Joback Calculated Property
Cp,gas	1645.55	J/mol×K	1058.43	Joback Calculated Property
Cp,gas	1696.03	J/mol×K	1097.61	Joback Calculated Property
Cp,gas	1750.35	J/mol×K	1136.78	Joback Calculated Property
Cp,gas	1809.09	J/mol×K	1175.96	Joback Calculated Property
Cp,gas	1872.84	J/mol×K	1215.13	Joback Calculated Property
Cp,gas	1942.16	J/mol×K	1254.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to 31-Nor-7-lanosterol acetate.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.