Chemical Properties of (E)-5-Hydroxy-2-isopropenyl-5-methyl-hex-3-enyl isobutyrate

InChI

InChI=1S/C14H24O3/c1-10(2)12(7-8-14(5,6)16)9-17-13(15)11(3)4/h7-8,11-12,16H,1,9H2,2-6H3/b8-7+

InChI Key

RGOXNJSZBDJLHQ-BQYQJAHWSA-N

Formula

C14H24O3

SMILES

C=C(C)C(C=CC(C)(C)O)COC(=O)C(C)C

Molecular Weight¹

240.34

• 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.
• I : 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	[594.65; 671.07]	J/mol×K	[684.80; 871.40]
Cp,gas	594.65	J/mol×K	684.80	Joback Calculated Property
Cp,gas	609.24	J/mol×K	715.90	Joback Calculated Property
Cp,gas	623.03	J/mol×K	747.00	Joback Calculated Property
Cp,gas	636.07	J/mol×K	778.10	Joback Calculated Property
Cp,gas	648.39	J/mol×K	809.20	Joback Calculated Property
Cp,gas	660.05	J/mol×K	840.30	Joback Calculated Property
Cp,gas	671.07	J/mol×K	871.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to (E)-5-Hydroxy-2-isopropenyl-5-methyl-hex-3-enyl isobutyrate.

Sources

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

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