Chemical Properties of Lanostan-3-one (CAS 4639-29-6)

InChI

InChI=1S/C30H52O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h20-25H,9-19H2,1-8H3/t21-,22-,23+,24-,25+,28-,29-,30+/m0/s1

InChI Key

ZOGAYFJCSHNPSM-KICGUJRESA-N

Formula

C30H52O

SMILES

CC(C)CCCC(C)C1CCC2(C)C3CCC4C(C)(C)C(=O)CCC4(C)C3CCC12C

Molecular Weight¹

428.73

CAS

4639-29-6

• 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°	203.95	kJ/mol	Joback Calculated Property
ΔfH°gas	-570.79	kJ/mol	Joback Calculated Property
ΔfusH°	27.05	kJ/mol	Joback Calculated Property
ΔvapH°	80.52	kJ/mol	Joback Calculated Property
log10WS	-8.82		Crippen Calculated Property
logPoct/wat	8.703		Crippen Calculated Property
McVol	391.690	ml/mol	McGowan Calculated Property
Pc	888.94	kPa	Joback Calculated Property
Inp	[2777.00; 2777.00]
Inp	2777.00		NIST
Inp	2777.00		NIST
Inp	2777.00		NIST
Tboil	983.33	K	Joback Calculated Property
Tc	1220.73	K	Joback Calculated Property
Tfus	598.88	K	Joback Calculated Property
Vc	1.486	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1532.35; 1854.65]	J/mol×K	[983.33; 1220.73]
Cp,gas	1532.35	J/mol×K	983.33	Joback Calculated Property
Cp,gas	1577.45	J/mol×K	1022.90	Joback Calculated Property
Cp,gas	1625.22	J/mol×K	1062.46	Joback Calculated Property
Cp,gas	1676.24	J/mol×K	1102.03	Joback Calculated Property
Cp,gas	1731.10	J/mol×K	1141.60	Joback Calculated Property
Cp,gas	1790.38	J/mol×K	1181.16	Joback Calculated Property
Cp,gas	1854.65	J/mol×K	1220.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Lanostan-3-one.

Sources

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

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