Chemical Properties of 9,19-Cyclolanost-24-en-3-ol, (3«beta»)- (CAS 469-38-5)

InChI

InChI=1S/C30H50O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,21-25,31H,8,10-19H2,1-7H3/t21?,22?,23?,24?,25-,27?,28?,29?,30?/m1/s1

InChI Key

ONQRKEUAIJMULO-BSLPMHFZSA-N

Formula

C30H50O

SMILES

CC(C)=CCCC(C)C1CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C

Molecular Weight¹

426.72

CAS

469-38-5

Other Names

• 9,19-Cyclo-9«beta»-lanost-24-en-3«beta»-ol
• Cycloartenol
• Handianol
• (2aR,3R,5aS,5bS,9S,11aR)-2a,5a,8,8-Tetramethyl-3-((R)-6-methylhept-5-en-2-yl)hexadecahydrocyclopenta[a]cyclopropa[e]phenanthren-9-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	0.6637		Relay (1.0) Calculated Property
ΔfG°	343.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-335.11	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	30.08	kJ/mol	Joback Calculated Property
ΔvapH°	146.48	kJ/mol	Relay (1.0) Calculated Property
IE	8.01	eV	Relay (1.0) Calculated Property
log10WS	-7.32		Relay (1.0) Calculated Property
logPoct/wat	8.169		Crippen Calculated Property
McVol	380.830	ml/mol	McGowan Calculated Property
Pc	1025.31	kPa	Joback Calculated Property
Inp	[3465.60; 3465.60]
Inp	3465.60		NIST
Inp	3465.60		NIST
Tboil	692.40	K	Relay (1.0) Calculated Property
Tc	1005.35	K	Relay (1.0) Calculated Property
Tfus	462.54	K	Relay (1.0) Calculated Property
Vc	1.391	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1536.63; 1958.34]	J/mol×K	[1010.61; 1244.98]
Cp,gas	1536.63	J/mol×K	1010.61	Joback Calculated Property
Cp,gas	1590.88	J/mol×K	1049.67	Joback Calculated Property
Cp,gas	1650.50	J/mol×K	1088.73	Joback Calculated Property
Cp,gas	1716.28	J/mol×K	1127.79	Joback Calculated Property
Cp,gas	1788.99	J/mol×K	1166.85	Joback Calculated Property
Cp,gas	1869.41	J/mol×K	1205.91	Joback Calculated Property
Cp,gas	1958.34	J/mol×K	1244.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to 9,19-Cyclolanost-24-en-3-ol, (3«beta»)-.

Sources

• Cheméo Relay (1.0)
• 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.