Chemical Properties of Hydratropic acid, oct-3-en-2-yl ester

InChI

InChI=1S/C17H24O2/c1-4-5-6-8-11-14(2)19-17(18)15(3)16-12-9-7-10-13-16/h7-15H,4-6H2,1-3H3/b11-8+

InChI Key

WWWYXJRNGBBOCF-DHZHZOJOSA-N

Formula

C17H24O2

SMILES

CCCCC=CC(C)OC(=O)C(C)c1ccccc1

Molecular Weight¹

260.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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°	46.09	kJ/mol	Joback Calculated Property
ΔfH°gas	-295.82	kJ/mol	Joback Calculated Property
ΔfusH°	29.77	kJ/mol	Joback Calculated Property
ΔvapH°	64.05	kJ/mol	Joback Calculated Property
log10WS	-4.83		Crippen Calculated Property
logPoct/wat	4.468		Crippen Calculated Property
McVol	229.770	ml/mol	McGowan Calculated Property
Pc	1728.90	kPa	Joback Calculated Property
Inp	[1743.00; 1743.00]
Inp	1743.00		NIST
Inp	1743.00		NIST
Tboil	694.61	K	Joback Calculated Property
Tc	901.31	K	Joback Calculated Property
Tfus	344.85	K	Joback Calculated Property
Vc	0.872	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[633.29; 723.92]	J/mol×K	[694.61; 901.31]
Cp,gas	633.29	J/mol×K	694.61	Joback Calculated Property
Cp,gas	650.94	J/mol×K	729.06	Joback Calculated Property
Cp,gas	667.51	J/mol×K	763.51	Joback Calculated Property
Cp,gas	683.04	J/mol×K	797.96	Joback Calculated Property
Cp,gas	697.59	J/mol×K	832.41	Joback Calculated Property
Cp,gas	711.20	J/mol×K	866.86	Joback Calculated Property
Cp,gas	723.92	J/mol×K	901.31	Joback Calculated Property
η	[0.0000800; 0.0025274]	Pa×s	[344.85; 694.61]
η	0.0025274	Pa×s	344.85	Joback Calculated Property
η	0.0009377	Pa×s	403.14	Joback Calculated Property
η	0.0004469	Pa×s	461.44	Joback Calculated Property
η	0.0002515	Pa×s	519.73	Joback Calculated Property
η	0.0001590	Pa×s	578.02	Joback Calculated Property
η	0.0001093	Pa×s	636.32	Joback Calculated Property
η	0.0000800	Pa×s	694.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to Hydratropic acid, oct-3-en-2-yl ester.

Sources

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

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