Chemical Properties of Cyclolaudenol acetate

InChI

InChI=1S/C33H54O2/c1-21(2)22(3)10-11-23(4)25-14-16-31(9)27-13-12-26-29(6,7)28(35-24(5)34)15-17-32(26)20-33(27,32)19-18-30(25,31)8/h22-23,25-28H,1,10-20H2,2-9H3/t22?,23?,25?,26-,27?,28?,30?,31-,32?,33?/m1/s1

InChI Key

XANCISIMFMVUPX-IAWCWMIVSA-N

Formula

C33H54O2

SMILES

C=C(C)C(C)CCC(C)C1CCC2(C)C3CCC4C(C)(C)C(OC(C)=O)CCC45CC35CCC12C

Molecular Weight¹

482.78

• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1746.73; 2234.36]	J/mol×K	[1055.44; 1298.17]
Cp,gas	1746.73	J/mol×K	1055.44	Joback Calculated Property
Cp,gas	1809.70	J/mol×K	1095.89	Joback Calculated Property
Cp,gas	1878.87	J/mol×K	1136.35	Joback Calculated Property
Cp,gas	1955.08	J/mol×K	1176.80	Joback Calculated Property
Cp,gas	2039.17	J/mol×K	1217.26	Joback Calculated Property
Cp,gas	2131.98	J/mol×K	1257.71	Joback Calculated Property
Cp,gas	2234.36	J/mol×K	1298.17	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclolaudenol acetate.

Sources

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

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