Chemical Properties of Lanosta-7,9(11)-dien-3-ol, acetate, (3«beta»)- (CAS 5600-01-1)

InChI

InChI=1S/C32H52O2/c1-21(2)11-10-12-22(3)24-15-19-32(9)26-13-14-27-29(5,6)28(34-23(4)33)17-18-30(27,7)25(26)16-20-31(24,32)8/h13,16,21-22,24,27-28H,10-12,14-15,17-20H2,1-9H3/t22-,24-,27+,28+,30-,31-,32+/m0/s1

InChI Key

FGNFBQUIVUFRIF-MTJKDGKCSA-N

Formula

C32H52O2

SMILES

CC(=O)OC1CCC2(C)C3=CCC4(C)C(C(C)CCCC(C)C)CCC4(C)C3=CCC2C1(C)C

Molecular Weight¹

468.75

CAS

5600-01-1

Other Names

• Lanosta-7,9(11)-dien-3«beta»-ol, acetate
• Dihydroagnosterol acetate
• 3«beta»-Acetoxylanosta-7,9(11)-diene
• Lanosta-7,9(11)-dien-3-yl acetate, (3«beta»)-
• 24-Dihydroagnosterol acetate

• 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°	157.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-606.21	kJ/mol	Joback Calculated Property
ΔfusH°	36.10	kJ/mol	Joback Calculated Property
ΔvapH°	92.09	kJ/mol	Joback Calculated Property
log10WS	-9.54		Crippen Calculated Property
logPoct/wat	8.906		Crippen Calculated Property
McVol	417.140	ml/mol	McGowan Calculated Property
Pc	835.31	kPa	Joback Calculated Property
Inp	[3286.00; 3286.00]
Inp	3286.00		NIST
Inp	3286.00		NIST
Tboil	1050.51	K	Joback Calculated Property
Tc	1290.54	K	Joback Calculated Property
Tfus	656.16	K	Joback Calculated Property
Vc	1.589	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1647.06; 2025.93]	J/mol×K	[1050.51; 1290.54]
Cp,gas	1647.06	J/mol×K	1050.51	Joback Calculated Property
Cp,gas	1698.15	J/mol×K	1090.52	Joback Calculated Property
Cp,gas	1753.23	J/mol×K	1130.52	Joback Calculated Property
Cp,gas	1812.93	J/mol×K	1170.53	Joback Calculated Property
Cp,gas	1877.86	J/mol×K	1210.53	Joback Calculated Property
Cp,gas	1948.66	J/mol×K	1250.54	Joback Calculated Property
Cp,gas	2025.93	J/mol×K	1290.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to Lanosta-7,9(11)-dien-3-ol, acetate, (3«beta»)-.

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.