Chemical Properties of 2-(4-Methylcyclohex-3-enyl)propan-2-yl 2,3,4,5,6-pentafluorobenzoate

InChI

InChI=1S/C17H17F5O2/c1-8-4-6-9(7-5-8)17(2,3)24-16(23)10-11(18)13(20)15(22)14(21)12(10)19/h4,9H,5-7H2,1-3H3

InChI Key

JCBVATYWTBSVOR-UHFFFAOYSA-N

Formula

C17H17F5O2

SMILES

CC1=CCC(C(C)(C)OC(=O)c2c(F)c(F)c(F)c(F)c2F)CC1

Molecular Weight¹

348.31

• 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	[662.53; 738.86]	J/mol×K	[733.04; 931.46]
Cp,gas	662.53	J/mol×K	733.04	Joback Calculated Property
Cp,gas	677.64	J/mol×K	766.11	Joback Calculated Property
Cp,gas	691.77	J/mol×K	799.18	Joback Calculated Property
Cp,gas	704.93	J/mol×K	832.25	Joback Calculated Property
Cp,gas	717.14	J/mol×K	865.32	Joback Calculated Property
Cp,gas	728.45	J/mol×K	898.39	Joback Calculated Property
Cp,gas	738.86	J/mol×K	931.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-(4-Methylcyclohex-3-enyl)propan-2-yl 2,3,4,5,6-pentafluorobenzoate.

Sources

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

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