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

• 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°	343.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-372.25	kJ/mol	Joback Calculated Property
ΔfusH°	30.08	kJ/mol	Joback Calculated Property
ΔvapH°	91.79	kJ/mol	Joback Calculated Property
log10WS	-8.91		Crippen 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	1010.61	K	Joback Calculated Property
Tc	1244.98	K	Joback Calculated Property
Tfus	636.32	K	Joback Calculated Property
Vc	1.456	m3/kmol	Joback 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

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

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