Chemical Properties of Jalcaguaianolide

InChI

InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h5,11,13-14H,1,4,6-7H2,2-3H3/t11-,13-,14?/m1/s1

InChI Key

WAQFXLYLGJEYAW-AYBZEELNSA-N

Formula

C15H18O2

SMILES

C=C1CCC2=C(C)C(=O)OC2C2C(C)=CCC12

Molecular Weight¹

230.30

• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[536.69; 632.78]	J/mol×K	[687.09; 925.52]
Cp,gas	536.69	J/mol×K	687.09	Joback Calculated Property
Cp,gas	555.78	J/mol×K	726.83	Joback Calculated Property
Cp,gas	573.58	J/mol×K	766.57	Joback Calculated Property
Cp,gas	590.13	J/mol×K	806.30	Joback Calculated Property
Cp,gas	605.48	J/mol×K	846.04	Joback Calculated Property
Cp,gas	619.68	J/mol×K	885.78	Joback Calculated Property
Cp,gas	632.78	J/mol×K	925.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to Jalcaguaianolide.

Sources

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

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