Chemical Properties of Cholest-7-en-3-ol, 4-methyl-, (3«beta»,4«alpha»,5«alpha»)- (CAS 481-25-4)

InChI

InChI=1S/C28H48O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h10,18-20,22-26,29H,7-9,11-17H2,1-6H3/t19-,20+,22-,23+,24+,25+,26+,27-,28+/m0/s1

InChI Key

LMYZQUNLYGJIHI-GQDVSBTQSA-N

Formula

C28H48O

SMILES

CC(C)CCCC(C)C1CCC2C3=CCC4C(C)C(O)CCC4(C)C3CCC21C

Molecular Weight¹

400.68

CAS

481-25-4

Other Names

• 4-«alpha»-Methyl-5-«alpha»-cholest-7-en-3-«beta»-ol

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.7007		Relay (... Calculated Property
ΔfG°	204.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-497.21	kJ/mol	Relay (... Calculated Property
ΔfusH°	39.88	kJ/mol	Joback Calculated Property
ΔvapH°	141.26	kJ/mol	Relay (... Calculated Property
IE	8.13	eV	Relay (... Calculated Property
log10WS	-7.34		Relay (... Calculated Property
logPoct/wat	7.635		Crippen Calculated Property
McVol	363.510	ml/mol	McGowan Calculated Property
Pc	992.63	kPa	Joback Calculated Property
Inp	[3225.00; 3225.00]
Inp	3225.00		NIST
Inp	3225.00		NIST
Tboil	686.28	K	Relay (... Calculated Property
Tc	964.75	K	Relay (... Calculated Property
Tfus	415.23	K	Relay (... Calculated Property
Vc	1.303	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1389.24; 1591.25]	J/mol×K	[965.59; 1187.42]
Cp,gas	1389.24	J/mol×K	965.59	Joback Calculated Property
Cp,gas	1420.61	J/mol×K	1002.56	Joback Calculated Property
Cp,gas	1452.48	J/mol×K	1039.53	Joback Calculated Property
Cp,gas	1485.16	J/mol×K	1076.51	Joback Calculated Property
Cp,gas	1518.98	J/mol×K	1113.48	Joback Calculated Property
Cp,gas	1554.23	J/mol×K	1150.45	Joback Calculated Property
Cp,gas	1591.25	J/mol×K	1187.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cholest-7-en-3-ol, 4-methyl-, (3«beta»,4«alpha»,5«alpha»)-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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